N-methyl-N-[(1-phenyl-1H-pyrazol-4-yl)methyl]but-2-ynamide
Chemical Structure Depiction of
N-methyl-N-[(1-phenyl-1H-pyrazol-4-yl)methyl]but-2-ynamide
N-methyl-N-[(1-phenyl-1H-pyrazol-4-yl)methyl]but-2-ynamide
Compound characteristics
| Compound ID: | T001-1203 |
| Compound Name: | N-methyl-N-[(1-phenyl-1H-pyrazol-4-yl)methyl]but-2-ynamide |
| Molecular Weight: | 253.3 |
| Molecular Formula: | C15 H15 N3 O |
| Smiles: | CC#CC(N(C)Cc1cnn(c1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2135 |
| logD: | 2.2135 |
| logSw: | -2.3265 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.4906 |
| InChI Key: | AKCDKMGHAYCUDO-UHFFFAOYSA-N |