C9H8N6O2 — CID 141129728
N'-(1H-imidazole-2-carbonyl)pyrazine-2-carbohydrazide (PubChem CID 141129728) has the molecular formula C9H8N6O2 and a molecular weight of 232.20 g/mol. Its IUPAC name is N'-(1H-imidazole-2-carbonyl)pyrazine-2-carbohydrazide.
| Compound Name | N'-(1H-imidazole-2-carbonyl)pyrazine-2-carbohydrazide |
|---|---|
| PubChem CID | 141129728 |
| Molecular Formula | C9H8N6O2 |
| Molecular Weight | 232.20 g/mol |
| Exact Mass | 232.07 |
| IUPAC Name | N'-(1H-imidazole-2-carbonyl)pyrazine-2-carbohydrazide |
| SMILES | O=C(NNC(=O)c1ncc[nH]1)c1cnccn1 |
| InChI | InChI=1S/C9H8N6O2/c16-8(6-5-10-1-2-11-6)14-15-9(17)7-12-3-4-13-7/h1-5H,(H,12,13)(H,14,16)(H,15,17) |
| InChIKey | LEZNCIPJOWFUSP-UHFFFAOYSA-N |
| XLogP | -0.73 |
| TPSA | 112.66 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 232.20 |
| LogP ≤ 5 | -0.73 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 5 |
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|