About N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide
N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide (PubChem CID 89034600) has the molecular formula C17H13N3O2
and a molecular weight of 291.31 g/mol. Its IUPAC name is N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide.
Molecular Properties
| Compound Name | N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide |
| PubChem CID | 89034600 |
| Molecular Formula | C17H13N3O2 |
| Molecular Weight | 291.31 g/mol |
| Exact Mass | 291.10 |
| IUPAC Name | N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide |
| SMILES | O=C(NO)c1cncc(-c2ccc(-c3cccnc3)cc2)c1 |
| InChI | InChI=1S/C17H13N3O2/c21-17(20-22)16-8-15(10-19-11-16)13-5-3-12(4-6-13)14-2-1-7-18-9-14/h1-11,22H,(H,20,21) |
| InChIKey | MIKAFWVWPDBWES-UHFFFAOYSA-N |
| XLogP | 2.93 |
| TPSA | 75.11 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 291.31 |
| LogP ≤ 5 | 2.93 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide (CID 89034600) is N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide is O=C(NO)c1cncc(-c2ccc(-c3cccnc3)cc2)c1.
What is the InChIKey of N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide?
The InChIKey is MIKAFWVWPDBWES-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O2/c21-17(20-22)16-8-15(10-19-11-16)13-5-3-12(4-6-13)14-2-1-7-18-9-14/h1-11,22H,(H,20,21).
What are the key properties of N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide?
N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide has a molecular weight of 291.31 g/mol, XLogP of 2.93, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-5-(4-pyridin-3-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 89034600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).