(R)-Nicotine
PubChem CID: 157672
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| Compound Synonyms | (+)-Nicotine, D-Nicotine, 25162-00-9, (R)-nicotine, Pseudonicotine, R-(+)-Nicotine, 2'-beta-H-Nicotine, Nicotine, (+)-, Pyridine, 3-[(2R)-1-methyl-2-pyrrolidinyl]-, (R)-3-(1-Methyl-2-pyrrolidinyl)pyridine, 3-[(2R)-1-methylpyrrolidin-2-yl]pyridine, D-(+)-Nicotine, (R)-(+)-Nicotine, UNII-42XNU684Z1, BRN 4666243, DTXSID0046351, CHEBI:39162, 42XNU684Z1, Pyridine, 3-(1-methyl-2-pyrrolidinyl)-, (R)-, 2'.BETA.H-NICOTINE, CHEMBL9732, (R)-3-(1-Methylpyrrolidin-2-yl)pyridine, DTXCID8026351, 5-23-06-00064 (Beilstein Handbook Reference), NCGC00163360-01, PYRIDINE, 3-((2R)-1-METHYL-2-PYRROLIDINYL)-, Nicotine-D salicylate, 3-((2R)-1-methylpyrrolidin-2-yl)pyridine, CAS-25162-00-9, Nicotine-L salicylate, 2'BETAH-NICOTINE, 3-[(2R)-1-Methyl-2-pyrrolidinyl]pyridine, 352-(+)-Nicotine, SCHEMBL20518, BDBM82068, SNICXCGAKADSCV-SNVBAGLBSA-N, Tox21_112053, PDSP1_000557, PDSP2_000113, R-(+)-Nicotine, [+]-1-Methyl-2-[3-pyridyl]pyrrolidine, Free Base, AKOS006238318, Tox21_112053_1, FN26197, NCGC00090693-11, NCGC00163360-02, NCGC00163360-03, AC-12917, AS-86486, G78132, (+)-NICOTINE-(+)-DI-P-TOLUOYL TARTRATE, Q27119762, Pyridine, 3-(1-methyl-2-pyrrolidinyl)-, (R)-(9CI) |
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| Topological Polar Surface Area | 16.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 12.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 147.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 1.0 |
| Uniprot Id | Q05941, P12390, P11509, P20852, P02545, Q9NUW8, P00352, Q92830, A9XFY4, n.a., P02710, P05412 |
| Iupac Name | 3-[(2R)-1-methylpyrrolidin-2-yl]pyridine |
| Prediction Hob | 1.0 |
| Target Id | NPT240, NPT483, NPT50, NPT94 |
| Xlogp | 1.2 |
| Molecular Formula | C10H14N2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | SNICXCGAKADSCV-SNVBAGLBSA-N |
| Fcsp3 | 0.5 |
| Logs | 0.613 |
| Rotatable Bond Count | 1.0 |
| Logd | 0.844 |
| Compound Name | (R)-Nicotine |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 162.116 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 162.116 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 162.23 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 1.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.0066127999999996 |
| 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-/m1/s1 |
| Smiles | CN1CCC[C@@H]1C2=CN=CC=C2 |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Piper Nigrum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all