5,5-dimethyl-3-[4-(propan-2-yl)anilino]cyclohex-2-en-1-one
Chemical Structure Depiction of
5,5-dimethyl-3-[4-(propan-2-yl)anilino]cyclohex-2-en-1-one
5,5-dimethyl-3-[4-(propan-2-yl)anilino]cyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 6260-2318 |
| Compound Name: | 5,5-dimethyl-3-[4-(propan-2-yl)anilino]cyclohex-2-en-1-one |
| Molecular Weight: | 257.37 |
| Molecular Formula: | C17 H23 N O |
| Smiles: | CC(C)c1ccc(cc1)NC1CC(C)(C)CC(C=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3462 |
| logD: | 4.3404 |
| logSw: | -4.3639 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.2657 |
| InChI Key: | LMXARVLWRNTTDS-UHFFFAOYSA-N |