A1AJN
Summary
| Name: | 1-[1-(pyridin-2-yl)cyclopentyl]methanamine |
| Formula: | C11 H16 N2 |
| Formal charge: | 0 |
| Formula weight: | 176.258 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-[1-(pyridin-2-yl)cyclopentyl]methanamine |
| OpenEye OEToolkits | 2.0.7 | (1-pyridin-2-ylcyclopentyl)methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | NCC1(CCCC1)c1ccccn1 |
| InChI | InChI | 1.06 | InChI=1S/C11H16N2/c12-9-11(6-2-3-7-11)10-5-1-4-8-13-10/h1,4-5,8H,2-3,6-7,9,12H2 |
| InChIKey | InChI | 1.06 | DQSRGJUPRBBWIV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NCC1(CCCC1)c2ccccn2 |
| SMILES | CACTVS | 3.385 | NCC1(CCCC1)c2ccccn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccnc(c1)C2(CCCC2)CN |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccnc(c1)C2(CCCC2)CN |
