2,2-dimethyl-N-(2-methyl-4-nitrophenyl)butanamide
Chemical Structure Depiction of
2,2-dimethyl-N-(2-methyl-4-nitrophenyl)butanamide
2,2-dimethyl-N-(2-methyl-4-nitrophenyl)butanamide
Compound characteristics
| Compound ID: | Y032-0981 |
| Compound Name: | 2,2-dimethyl-N-(2-methyl-4-nitrophenyl)butanamide |
| Molecular Weight: | 250.3 |
| Molecular Formula: | C13 H18 N2 O3 |
| Smiles: | CCC(C)(C)C(Nc1ccc(cc1C)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6458 |
| logD: | 3.6307 |
| logSw: | -3.7742 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.285 |
| InChI Key: | YMKLAXSFMYVALZ-UHFFFAOYSA-N |