3-(butylamino)-5,5-dimethylcyclohex-2-en-1-one
Chemical Structure Depiction of
3-(butylamino)-5,5-dimethylcyclohex-2-en-1-one
3-(butylamino)-5,5-dimethylcyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 0709-0261 |
| Compound Name: | 3-(butylamino)-5,5-dimethylcyclohex-2-en-1-one |
| Molecular Weight: | 195.3 |
| Molecular Formula: | C12 H21 N O |
| Smiles: | CCCCNC1CC(C)(C)CC(C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5514 |
| logD: | 2.5496 |
| logSw: | -2.4183 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.7009 |
| InChI Key: | RUPJSSMIJPRJDH-UHFFFAOYSA-N |