C13H12N4O — CID 112521790
N-(5-methyl-1H-pyrazol-4-yl)-1H-indole-5-carboxamide (PubChem CID 112521790) has the molecular formula C13H12N4O and a molecular weight of 240.27 g/mol. Its IUPAC name is N-(5-methyl-1H-pyrazol-4-yl)-1H-indole-5-carboxamide.
| Compound Name | N-(5-methyl-1H-pyrazol-4-yl)-1H-indole-5-carboxamide |
|---|---|
| PubChem CID | 112521790 |
| Molecular Formula | C13H12N4O |
| Molecular Weight | 240.27 g/mol |
| Exact Mass | 240.10 |
| IUPAC Name | N-(5-methyl-1H-pyrazol-4-yl)-1H-indole-5-carboxamide |
| SMILES | Cc1[nH]ncc1NC(=O)c1ccc2[nH]ccc2c1 |
| InChI | InChI=1S/C13H12N4O/c1-8-12(7-15-17-8)16-13(18)10-2-3-11-9(6-10)4-5-14-11/h2-7,14H,1H3,(H,15,17)(H,16,18) |
| InChIKey | LQFDVVUKNOAUNF-UHFFFAOYSA-N |
| XLogP | 2.45 |
| TPSA | 73.57 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 240.27 |
| LogP ≤ 5 | 2.45 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 2 |