HNL
Summary
| Name: | 5-[(2S)-1-methylpyrrolidin-2-yl]pyridin-2-ol |
| Synonyms: | 6-hydroxy-L-nicotine |
| Formula: | C10 H14 N2 O |
| Formal charge: | 0 |
| Formula weight: | 178.231 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 11.02 | 5-[(2S)-1-methylpyrrolidin-2-yl]pyridin-2-ol |
| OpenEye OEToolkits | 1.6.1 | 5-[(1R,2S)-1-methylpyrrolidin-2-yl]pyridin-2-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 11.02 | n1cc(ccc1O)C2N(C)CCC2 |
| SMILES_CANONICAL | CACTVS | 3.352 | CN1CCC[C@H]1c2ccc(O)nc2 |
| SMILES | CACTVS | 3.352 | CN1CCC[CH]1c2ccc(O)nc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C[N@@]1CCC[C@H]1c2ccc(nc2)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | CN1CCCC1c2ccc(nc2)O |
| InChI | InChI | 1.03 | InChI=1S/C10H14N2O/c1-12-6-2-3-9(12)8-4-5-10(13)11-7-8/h4-5,7,9H,2-3,6H2,1H3,(H,11,13)/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | ATRCOGLZUCICIV-VIFPVBQESA-N |
