PubChem CID | 89594 |
Molecular Formula | C10H14N2 |
Structure |
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Synonyms |
nicotine
L-Nicotine 54-11-5 (-)-Nicotine (S)-Nicotine (S)-3-(1-methylpyrrolidin-2-yl)pyridine Habitrol (S)-(-)-Nicotine Nicotrol Nicoderm 3-[(2S)-1-methylpyrrolidin-2-yl]pyridine Nicotine polacrilex Fumetobac Micotine Nicocide Prostep Tendust Nico-dust Nicoderm Cq Nicotine alkaloid Emo-nik Nico-Fume Mach-Nic Nic-Sal Flux MAAG Nicotina Nikotyna Ortho N-4 dust Ortho N-5 dust XL All Insecticide Niagara P.A. dust Destruxol orchid spray L(-)-nicotine 3-(N-Methylpyrollidino)pyridine 3-(N-Methylpyrrolidino)pyridine Nicabate Nicorette Nicotinum Niquitin Tabazur L-3-(1-Methyl-2-pyrrolidyl)pyridine Caswell No. 597 Ortho N-4 and N-5 dusts Nicotin (-)-3-(1-Methyl-2-pyrrolidyl)pyridine (S)-3-(1-Methyl-2-pyrrolidinyl)pyridine RCRA waste number P075 1-Methyl-2-(3-pyridyl)pyrrolidine NSC 5065 S-(-)-Nicotine Nikotin ENT 3,424 3-(2-(N-methylpyrrolidinyl))pyridine CCRIS 1637 fumeto bac HSDB 1107 Pyridine, 3-(1-methyl-2-pyrrolidinyl)-, (S)- 3-((2S)-1-methylpyrrolidin-2-yl)pyridine EINECS 200-193-3 UNII-6M3C89ZY6R nicotine s(-) (-)-3-(N-Methylpyrrolidino)pyridine 3-(1-Methyl-2-pyrollidinyl)pyridine beta-Pyridyl-alpha-N-methylpyrrolidine EPA Pesticide Chemical Code 056702 beta-Pyridyl-alpha-N-methyl pyrrolidine 6M3C89ZY6R Pyrrolidine, 1-methyl-2-(3-pyridal)- DTXSID1020930 CHEBI:17688 (S)-3-(N-methylpyrrolidin-2-yl)pyridine AI3-03424 3-(1-Methyl-2-pyrrolidinyl)pyridine Nicotine [USP:BAN] Pyridine, 3-(tetrahydro-1-methylpyrrol-2-yl) MFCD00006369 Pyrrolidine, 1-methyl-2-(3-pyridyl)- DTXCID50930 EC 200-193-3 Pyridine, 3-((2S)-1-methyl-2-pyrrolidinyl)- NSC-5065 1-Methyl-2-(3-pyridiyl)pyrrolidine Nikotin [German] Nikotyna [Polish] 104062-50-2 Nicotina [Italian] Nicotine (USP:BAN) Nicotrol Inhaler NICOTINE (MART.) NICOTINE [MART.] Nicotrol NS Nicotine [for single use] NICOTINE-L (BASE) destruxol Pyridine, 3-[(2S)-1-methyl-2-pyrrolidinyl]- 3-((2S)-1-METHYL-2-PYRROLIDINYL)PYRIDINE (-)-1-Methyl-2-(3-pyridyl)pyrrolidine NICOTINE (EP MONOGRAPH) NICOTINE [EP MONOGRAPH] NICOTINE (USP MONOGRAPH) NICOTINE [USP MONOGRAPH] Nicotine [BSI:ISO] Exodus Nicotine-D salicylate CAS-54-11-5 DL-tetrahydronicotyrine Habitrol (TN) Nicotine (USP) Nicotine [ISO] SMR000059074 (S)-(-)-Nicotine (1.0 mg/mL in Methanol) methyl-2-pyrrolidinyl)pyridine UN1654 RCRA waste no. P075 CHEBI:18723 blip Nicorelief bjwc nicotine euqate nicotine NicoretteMint NicotineMini nictoine gum delta-Nicotine Lucy nicotine Nicorette gum Equate Nicotine Leader Nicotine Rexall Nicotine Maxi Nicotine Mini Nicotine Nicotine betadex Nicotine Mini Nicotinum, Careone Nicotine Good Sense Habitrol Lozenge NicoretteOriginal Sunmark Nicotine Topcare Nicotine 1-methyl-2-(3-pyridal)-pyrrolidene HabitrolStep 1 HabitrolStep 2 HabitrolStep 3 Equaline Nicotine HEB Nicotine Nicotine polarilex Nicotinetransdermal Stop Smoking Aid nicotinemint flavor NicotineSugar Free Care One Nicotine DG Health nicotine NicoretteFresh Mint 3-(1-Methyl-2-pyrrolidyl)pyridine Basic Care Nicotine Good Sense Nicotine NicoretteFruit Chill Up and Up Nicotine Health Mart Nicotine MACHNIC NICODERMCQ Topcare Nicotine Gum a-N-methylpyrrolidine Campbell's nico-soap Caswell No 597 3-N-methylpyrrolidine Habitrol LozengeCherry Members Mark Nicotine R)-(+)-nicotine good sense nicotinemint Harris Teeter Nicotine a -N-methylpyrrolidine NicoretteCinnamon Surge TEN DUST CHEMBL3 NIAGARA PA DUST Signature Care Nicotine 1uw6 exchange select nicotine family wellness nicotine NicoretteSpearmint Burst Nicotine PolacrilexMINT NicoretteWhite Ice Mint basic care nicotine mini NICOTINE [HSDB] up and up mini nicotine NICOTINE (TPD) alpha-N-methylpyrrolidine NICOTINE [MI] Nicotine [UN1654] NICOTINE [VANDF] Nicotinetransdermal system NICOTINUM [HPUS] (S)-(-)--nicotine foster and thrive nicotine Nicotine COATED ice mint Nicotine Polacrilexoriginal Kirkland Signature Quit 2 Kirkland Signature Quit 4 bmse000105 Kirkland Signature Nicotine Members Mark Mini Nicotine NICOTINE [WHO-DD] (2S) 3-(1-Methyl-pyrrolidin-2-yl)-pyridine Berkley and Jensen Nicotine NICOTINE, (LIQUID) Nicotine polacrilex [USAN] Pyridine, 3-(1-methyl-2-pyrrolidinyl)-,(S)- S-()-Nicotine-pyridine-d4 SCHEMBL20192 MLS001055457 MLS001335905 Nicotine Polacrilexcoated mint BIDD:GT0599 Habitrol LozengeOriginal Flavor NICOTINE [ORANGE BOOK] Good Neighbor Pharmacy Nicotine GTPL2585 BDBM82070 l-Nicotine, 1mg/ml in Methanol Nicotine Polacrilexcoated cinnamon Nicotine Transdermal System Patch Nicotinetransdermal system step 2 l-Nicotine, 10mg/ml in Methanol l-Nicotine, 50mg/ml in Methanol Nicotine PolacrilexOrigianl Flavor Nicotine PolacrilexOriginal Flavor Nicotine Transdermal SystemStep 1 Nicotine Transdermal SystemStep 2 Nicotine Transdermal SystemStep 3 HMS2230H17 HMS3259E16 Nicotine [UN1654] [Poison] Nicotine PolacrilexCoated Ice Mint good neighbor pharmacy nicotine mini HY-B0638 l-Nicotine, 100mg/ml in Methanol Nicotine 10 microg/mL in Methanol NICOTINE COMPONENT OF COMMIT NICOTINETransdermal System Step 1 NICOTINETransdermal System Step 3 Good Sense NicotineStop Smoking Aid Tox21_201814 Tox21_300174 Nicotine 100 microg/mL in Methanol PDSP1_000113 PDSP1_000465 PDSP2_000463 PDSP2_000555 1-methyl-2-(3-pyridal)-Pyrrolidine AKOS016843798 Nicotac Nicotine PolacrilexCoated Mint Nicotine 1000 microg/mL in Methanol NICOTINE COMPONENT OF NICORETTE 3-(1-methyl-2-pyrrolidinyl)-Pyridine CCG-204892 CS-3999 DB00184 NC00577 SB12751 SDCCGMLS-0066911.P001 SDCCGSBI-0050785.P004 USEPA/OPP Pesticide Code: 056702 NCGC00090693-01 NCGC00090693-02 NCGC00090693-03 NCGC00090693-04 NCGC00090693-05 NCGC00090693-06 NCGC00090693-07 NCGC00090693-08 NCGC00090693-09 NCGC00254095-01 NCGC00259363-01 (-)-Nicotine, >=99% (GC), liquid Nicotac Nicotine PolacrilexCoated Cinnamon 3-[(S)-1-Methylpyrrolidin-2-yl]pyridine NICOTINE COMPOUND, LIQUID, N.O.S. SBI-0050785.P003 CAS_29790-52-1 N0079 NS00010445 NICOTINE PREPARATION, LIQUID, N.O.S. C00745 D03365 EN300-304948 LEADER NICOTINE TRANSDERMAL SYSTEMSTEP 1 LEADER NICOTINE TRANSDERMAL SYSTEMSTEP 2 LEADER NICOTINE TRANSDERMAL SYSTEMSTEP 3 P10017 PYRROLIDENE, 1-METHYL-2-(3-PYRIDAL)- (-)-.beta.-Pyridyl-.alpha.-N-methylpyrrolidine AB00694322_12 (-)-Nicotine, PESTANAL(R), analytical standard J-500021 SR-05000001762-5 BRD-K05395900-322-02-1 BRD-K05395900-322-04-7 BRD-K05395900-322-05-4 Pyridine, 3-(tetrahydro-1-methylpyrrol-2-yl), (S)- Q28086552 PYRIDINE, 3-(TETRAHYDRO-1-METHYL PYRROL-2-YL) Z1198150037 434F7990-3240-4A43-ACEC-E6CC1E495FA0 (S)-(-)-NICOTINE; 3-[(2S)-1-METHYL-2-PYRROLIDINYL] PYRIDINE |
IUPAC Name | 3-[(2S)-1-methylpyrrolidin-2-yl]pyridine |
SMILES | CN1CCC[C@H]1C2=CN=CC=C2 |
Canonical SMILES | CN1CCCC1C2=CN=CC=C2 |
InChI | InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1 |
InChIKey | SNICXCGAKADSCV-JTQLQIEISA-N |
Molecular Weight | 162.23 g/mol |
XLogP3 | 1.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 1 |
Exact Mass | 162.116 |
Monoisotopic Mass | 162.116 |
Topological Polar Surface Area | 16.1 |
Heavy Atom Count | 12 |
Formal Charge | 0 |
Complexity | 147 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 1 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Insect | Gene Symbol | Validation | Reference |
---|---|---|---|
Aphis gossypii | CYP6CY22 | R,D | |
Bemisia tabaci | CYP6CM1 | R | |
Myzus persicae | CYP6CY3 | D | |
Nilaparvata lugens | CYP6AY1 | R | |
Spodoptera litura | CYP9A75A | R |