2-{[(3-hydroxypropyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Chemical Structure Depiction of
2-{[(3-hydroxypropyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
2-{[(3-hydroxypropyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Compound characteristics
| Compound ID: | 2104-0010 |
| Compound Name: | 2-{[(3-hydroxypropyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione |
| Molecular Weight: | 225.29 |
| Molecular Formula: | C12 H19 N O3 |
| Smiles: | CC1(C)CC(C(=CNCCCO)C(C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2766 |
| logD: | -0.2774 |
| logSw: | -0.2413 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.556 |
| InChI Key: | AOZZNEKVPCQUJL-UHFFFAOYSA-N |