About 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide
2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide (PubChem CID 46226284) has the molecular formula C20H15N5O2
and a molecular weight of 357.37 g/mol. Its IUPAC name is 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide.
Molecular Properties
| Compound Name | 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide |
| PubChem CID | 46226284 |
| Molecular Formula | C20H15N5O2 |
| Molecular Weight | 357.37 g/mol |
| Exact Mass | 357.12 |
| IUPAC Name | 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide |
| SMILES | NC(=O)c1cccc2cn(-c3ccc(C(=O)Nc4ccncc4)cc3)nc12 |
| InChI | InChI=1S/C20H15N5O2/c21-19(26)17-3-1-2-14-12-25(24-18(14)17)16-6-4-13(5-7-16)20(27)23-15-8-10-22-11-9-15/h1-12H,(H2,21,26)(H,22,23,27) |
| InChIKey | BNJFCNFCPGNRBQ-UHFFFAOYSA-N |
| XLogP | 2.77 |
| TPSA | 102.90 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 357.37 |
| LogP ≤ 5 | 2.77 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide?
The IUPAC name of 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide (CID 46226284) is 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide.
What is the SMILES notation for 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide?
The canonical SMILES for 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide is NC(=O)c1cccc2cn(-c3ccc(C(=O)Nc4ccncc4)cc3)nc12.
What is the InChIKey of 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide?
The InChIKey is BNJFCNFCPGNRBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O2/c21-19(26)17-3-1-2-14-12-25(24-18(14)17)16-6-4-13(5-7-16)20(27)23-15-8-10-22-11-9-15/h1-12H,(H2,21,26)(H,22,23,27).
What are the key properties of 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide?
2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide has a molecular weight of 357.37 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(pyridin-4-ylcarbamoyl)phenyl]indazole-7-carboxamide is sourced from PubChem (CID 46226284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).