A1CHE
Summary
| Name: | 3-[1-(piperidin-1-yl)cyclohexyl]phenol |
| Formula: | C17 H25 N O |
| Formal charge: | 0 |
| Formula weight: | 259.386 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 3-[1-(piperidin-1-yl)cyclohexyl]phenol |
| OpenEye OEToolkits | 3.1.0.0 | 3-(1-piperidin-1-ylcyclohexyl)phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Oc1cccc(c1)C1(CCCCC1)N1CCCCC1 |
| InChI | InChI | 1.06 | InChI=1S/C17H25NO/c19-16-9-7-8-15(14-16)17(10-3-1-4-11-17)18-12-5-2-6-13-18/h7-9,14,19H,1-6,10-13H2 |
| InChIKey | InChI | 1.06 | AMSXTZUCNOKUEN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1cccc(c1)C2(CCCCC2)N3CCCCC3 |
| SMILES | CACTVS | 3.385 | Oc1cccc(c1)C2(CCCCC2)N3CCCCC3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1cc(cc(c1)O)C2(CCCCC2)N3CCCCC3 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1cc(cc(c1)O)C2(CCCCC2)N3CCCCC3 |
