C12H15N3OS — CID 47343840
N-(5-thiophen-2-yl-1H-pyrazol-3-yl)pentanamide (PubChem CID 47343840) has the molecular formula C12H15N3OS and a molecular weight of 249.34 g/mol. Its IUPAC name is N-(5-thiophen-2-yl-1H-pyrazol-3-yl)pentanamide.
| Compound Name | N-(5-thiophen-2-yl-1H-pyrazol-3-yl)pentanamide |
|---|---|
| PubChem CID | 47343840 |
| Molecular Formula | C12H15N3OS |
| Molecular Weight | 249.34 g/mol |
| Exact Mass | 249.09 |
| IUPAC Name | N-(5-thiophen-2-yl-1H-pyrazol-3-yl)pentanamide |
| SMILES | CCCCC(=O)Nc1cc(-c2cccs2)[nH]n1 |
| InChI | InChI=1S/C12H15N3OS/c1-2-3-6-12(16)13-11-8-9(14-15-11)10-5-4-7-17-10/h4-5,7-8H,2-3,6H2,1H3,(H2,13,14,15,16) |
| InChIKey | UFALUZCPMNDFNE-UHFFFAOYSA-N |
| XLogP | 3.27 |
| TPSA | 57.78 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 249.34 |
| LogP ≤ 5 | 3.27 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |