C13H11N3OS — CID 123632210
N-(3-methyl-2H-indazol-5-yl)thiophene-2-carboxamide (PubChem CID 123632210) has the molecular formula C13H11N3OS and a molecular weight of 257.32 g/mol. Its IUPAC name is N-(3-methyl-2H-indazol-5-yl)thiophene-2-carboxamide.
| Compound Name | N-(3-methyl-2H-indazol-5-yl)thiophene-2-carboxamide |
|---|---|
| PubChem CID | 123632210 |
| Molecular Formula | C13H11N3OS |
| Molecular Weight | 257.32 g/mol |
| Exact Mass | 257.06 |
| IUPAC Name | N-(3-methyl-2H-indazol-5-yl)thiophene-2-carboxamide |
| SMILES | Cc1[nH]nc2ccc(NC(=O)c3cccs3)cc12 |
| InChI | InChI=1S/C13H11N3OS/c1-8-10-7-9(4-5-11(10)16-15-8)14-13(17)12-3-2-6-18-12/h2-7H,1H3,(H,14,17)(H,15,16) |
| InChIKey | GUCRHXITCJKACM-UHFFFAOYSA-N |
| XLogP | 3.19 |
| TPSA | 57.78 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 257.32 |
| LogP ≤ 5 | 3.19 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |