3-(4-methoxyanilino)-5,5-dimethylcyclohex-2-en-1-one
Chemical Structure Depiction of
3-(4-methoxyanilino)-5,5-dimethylcyclohex-2-en-1-one
3-(4-methoxyanilino)-5,5-dimethylcyclohex-2-en-1-one
Compound characteristics
| Compound ID: | 2104-0074 |
| Compound Name: | 3-(4-methoxyanilino)-5,5-dimethylcyclohex-2-en-1-one |
| Molecular Weight: | 245.32 |
| Molecular Formula: | C15 H19 N O2 |
| Smiles: | CC1(C)CC(=CC(C1)=O)Nc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.9904 |
| logD: | 2.973 |
| logSw: | -3.4481 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.8095 |
| InChI Key: | NRCVKUDLIIDNJU-UHFFFAOYSA-N |