About N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide
N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide (PubChem CID 69065534) has the molecular formula C18H13N3O2
and a molecular weight of 303.32 g/mol. Its IUPAC name is N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide.
Molecular Properties
| Compound Name | N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide |
| PubChem CID | 69065534 |
| Molecular Formula | C18H13N3O2 |
| Molecular Weight | 303.32 g/mol |
| Exact Mass | 303.10 |
| IUPAC Name | N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide |
| SMILES | O=C(Nc1n[nH]c2cc(-c3ccccc3)ccc12)c1ccco1 |
| InChI | InChI=1S/C18H13N3O2/c22-18(16-7-4-10-23-16)19-17-14-9-8-13(11-15(14)20-21-17)12-5-2-1-3-6-12/h1-11H,(H2,19,20,21,22) |
| InChIKey | DJHQJOQBFJVODF-UHFFFAOYSA-N |
| XLogP | 4.08 |
| TPSA | 70.92 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 303.32 |
| LogP ≤ 5 | 4.08 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide?
The IUPAC name of N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide (CID 69065534) is N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide.
What is the SMILES notation for N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide?
The canonical SMILES for N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide is O=C(Nc1n[nH]c2cc(-c3ccccc3)ccc12)c1ccco1.
What is the InChIKey of N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide?
The InChIKey is DJHQJOQBFJVODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O2/c22-18(16-7-4-10-23-16)19-17-14-9-8-13(11-15(14)20-21-17)12-5-2-1-3-6-12/h1-11H,(H2,19,20,21,22).
What are the key properties of N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide?
N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide has a molecular weight of 303.32 g/mol, XLogP of 4.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-phenyl-1H-indazol-3-yl)furan-2-carboxamide is sourced from PubChem (CID 69065534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).