C20H13N5O — CID 89459269
N-(4-cyanophenyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide (PubChem CID 89459269) has the molecular formula C20H13N5O and a molecular weight of 339.36 g/mol. Its IUPAC name is N-(4-cyanophenyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide.
| Compound Name | N-(4-cyanophenyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide |
|---|---|
| PubChem CID | 89459269 |
| Molecular Formula | C20H13N5O |
| Molecular Weight | 339.36 g/mol |
| Exact Mass | 339.11 |
| IUPAC Name | N-(4-cyanophenyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide |
| SMILES | N#Cc1ccc(NC(=O)c2n[nH]c3ccc(-c4cccnc4)cc23)cc1 |
| InChI | InChI=1S/C20H13N5O/c21-11-13-3-6-16(7-4-13)23-20(26)19-17-10-14(5-8-18(17)24-25-19)15-2-1-9-22-12-15/h1-10,12H,(H,23,26)(H,24,25) |
| InChIKey | KQCXJHTXQAHECK-UHFFFAOYSA-N |
| XLogP | 3.75 |
| TPSA | 94.46 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 26 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 339.36 |
| LogP ≤ 5 | 3.75 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |