1-methyl-N-(2,4,4-trimethylpentan-2-yl)-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
1-methyl-N-(2,4,4-trimethylpentan-2-yl)-1H-pyrazole-5-carboxamide
1-methyl-N-(2,4,4-trimethylpentan-2-yl)-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | Y206-5208 |
| Compound Name: | 1-methyl-N-(2,4,4-trimethylpentan-2-yl)-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 237.34 |
| Molecular Formula: | C13 H23 N3 O |
| Smiles: | CC(C)(C)CC(C)(C)NC(c1ccnn1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3128 |
| logD: | 2.3127 |
| logSw: | -2.8352 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.864 |
| InChI Key: | IIIAQIMFRGLWOJ-UHFFFAOYSA-N |