About N-hydroxy-2-oxo-1H-pyridine-3-carboxamide
N-hydroxy-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 6320121) has the molecular formula C6H6N2O3
and a molecular weight of 154.12 g/mol. Its IUPAC name is N-hydroxy-2-oxo-1H-pyridine-3-carboxamide.
Molecular Properties
| Compound Name | N-hydroxy-2-oxo-1H-pyridine-3-carboxamide |
| PubChem CID | 6320121 |
| Molecular Formula | C6H6N2O3 |
| Molecular Weight | 154.12 g/mol |
| Exact Mass | 154.04 |
| IUPAC Name | N-hydroxy-2-oxo-1H-pyridine-3-carboxamide |
| SMILES | O=C(NO)c1ccc[nH]c1=O |
| InChI | InChI=1S/C6H6N2O3/c9-5-4(6(10)8-11)2-1-3-7-5/h1-3,11H,(H,7,9)(H,8,10) |
| InChIKey | GTGJCZVKCORHAR-UHFFFAOYSA-N |
| XLogP | -0.51 |
| TPSA | 82.19 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 154.12 |
| LogP ≤ 5 | -0.51 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
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-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-hydroxy-2-oxo-1H-pyridine-3-carboxamide (CID 6320121) is N-hydroxy-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-hydroxy-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-hydroxy-2-oxo-1H-pyridine-3-carboxamide is O=C(NO)c1ccc[nH]c1=O.
What is the InChIKey of N-hydroxy-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is GTGJCZVKCORHAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2O3/c9-5-4(6(10)8-11)2-1-3-7-5/h1-3,11H,(H,7,9)(H,8,10).
What are the key properties of N-hydroxy-2-oxo-1H-pyridine-3-carboxamide?
N-hydroxy-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 154.12 g/mol, XLogP of -0.51, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 6320121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).