N-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]adamantane-1-carboxamide
Chemical Structure Depiction of
N-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]adamantane-1-carboxamide
N-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y500-2466 |
| Compound Name: | N-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]adamantane-1-carboxamide |
| Molecular Weight: | 318.37 |
| Molecular Formula: | C16 H22 N4 O3 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)C(NCCn1cc(cn1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5755 |
| logD: | 2.5755 |
| logSw: | -2.7246 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.664 |
| InChI Key: | HZPZEXVGBVIBFM-UHFFFAOYSA-N |