C7H6N4O2 — CID 130615800
7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 130615800) has the molecular formula C7H6N4O2 and a molecular weight of 178.15 g/mol. Its IUPAC name is 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.
| Compound Name | 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide |
|---|---|
| PubChem CID | 130615800 |
| Molecular Formula | C7H6N4O2 |
| Molecular Weight | 178.15 g/mol |
| Exact Mass | 178.05 |
| IUPAC Name | 7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| SMILES | NC(=O)c1c[nH]n2c(=O)ccnc12 |
| InChI | InChI=1S/C7H6N4O2/c8-6(13)4-3-10-11-5(12)1-2-9-7(4)11/h1-3,10H,(H2,8,13) |
| InChIKey | VBGZBOVVPHRZBP-UHFFFAOYSA-N |
| XLogP | -0.88 |
| TPSA | 93.25 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 13 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 178.15 |
| LogP ≤ 5 | -0.88 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |