RDV
Summary
| Name: | 3-cyclopentyl-1-(piperazin-1-yl)propan-1-one |
| Formula: | C12 H22 N2 O |
| Formal charge: | 0 |
| Formula weight: | 210.316 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-cyclopentyl-1-(piperazin-1-yl)propan-1-one |
| OpenEye OEToolkits | 2.0.6 | 3-cyclopentyl-1-piperazin-1-yl-propan-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C2C(CCC(=O)N1CCNCC1)CCC2 |
| InChI | InChI | 1.03 | InChI=1S/C12H22N2O/c15-12(14-9-7-13-8-10-14)6-5-11-3-1-2-4-11/h11,13H,1-10H2 |
| InChIKey | InChI | 1.03 | PUCYMVZANVWWKV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C(CCC1CCCC1)N2CCNCC2 |
| SMILES | CACTVS | 3.385 | O=C(CCC1CCCC1)N2CCNCC2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C1CCC(C1)CCC(=O)N2CCNCC2 |
| SMILES | OpenEye OEToolkits | 2.0.6 | C1CCC(C1)CCC(=O)N2CCNCC2 |
