A1CX8
Summary
| Name: | 2-{[(1R,2R)-2-methylcyclopentyl]amino}ethan-1-ol |
| Formula: | C8 H17 N O |
| Formal charge: | 0 |
| Formula weight: | 143.227 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 2-{[(1R,2R)-2-methylcyclopentyl]amino}ethan-1-ol |
| OpenEye OEToolkits | 3.1.0.0 | 2-[[(1~{R},2~{R})-2-methylcyclopentyl]amino]ethanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | OCCNC1CCCC1C |
| InChI | InChI | 1.06 | InChI=1S/C8H17NO/c1-7-3-2-4-8(7)9-5-6-10/h7-10H,2-6H2,1H3/t7-,8-/m1/s1 |
| InChIKey | InChI | 1.06 | VZZLRLOGBIIRNV-HTQZYQBOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H]1CCC[C@H]1NCCO |
| SMILES | CACTVS | 3.385 | C[CH]1CCC[CH]1NCCO |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[C@@H]1CCC[C@H]1NCCO |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC1CCCC1NCCO |
