A1BFM
Summary
| Name: | (1R)-1-(1-cyclopentyl-1H-pyrazol-4-yl)ethan-1-ol |
| Formula: | C10 H16 N2 O |
| Formal charge: | 0 |
| Formula weight: | 180.247 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | (1R)-1-(1-cyclopentyl-1H-pyrazol-4-yl)ethan-1-ol |
| OpenEye OEToolkits | 3.1.0.0 | (1~{R})-1-(1-cyclopentylpyrazol-4-yl)ethanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | CC(O)c1cn(nc1)C1CCCC1 |
| InChI | InChI | 1.06 | InChI=1S/C10H16N2O/c1-8(13)9-6-11-12(7-9)10-4-2-3-5-10/h6-8,10,13H,2-5H2,1H3 |
| InChIKey | InChI | 1.06 | TUZCKTQECDPISK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@@H](O)c1cnn(c1)C2CCCC2 |
| SMILES | CACTVS | 3.385 | C[CH](O)c1cnn(c1)C2CCCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | C[C@H](c1cnn(c1)C2CCCC2)O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC(c1cnn(c1)C2CCCC2)O |
