N-methyl-N-{2-oxo-2-[4-(trifluoromethyl)anilino]ethyl}prop-2-ynamide
Chemical Structure Depiction of
N-methyl-N-{2-oxo-2-[4-(trifluoromethyl)anilino]ethyl}prop-2-ynamide
N-methyl-N-{2-oxo-2-[4-(trifluoromethyl)anilino]ethyl}prop-2-ynamide
Compound characteristics
| Compound ID: | T001-2233 |
| Compound Name: | N-methyl-N-{2-oxo-2-[4-(trifluoromethyl)anilino]ethyl}prop-2-ynamide |
| Molecular Weight: | 284.24 |
| Molecular Formula: | C13 H11 F3 N2 O2 |
| Smiles: | CN(CC(Nc1ccc(cc1)C(F)(F)F)=O)C(C#C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.94 |
| logD: | 1.94 |
| logSw: | -2.6789 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.282 |
| InChI Key: | VUEFOFVFEXZNLP-UHFFFAOYSA-N |