About 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide
1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide (PubChem CID 59149002) has the molecular formula C7H8N2O3
and a molecular weight of 168.15 g/mol. Its IUPAC name is 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide.
Molecular Properties
| Compound Name | 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide |
| PubChem CID | 59149002 |
| Molecular Formula | C7H8N2O3 |
| Molecular Weight | 168.15 g/mol |
| Exact Mass | 168.05 |
| IUPAC Name | 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide |
| SMILES | CNC(=O)c1cccc(=O)n1O |
| InChI | InChI=1S/C7H8N2O3/c1-8-7(11)5-3-2-4-6(10)9(5)12/h2-4,12H,1H3,(H,8,11) |
| InChIKey | PEALCMWAXXMUSQ-UHFFFAOYSA-N |
| XLogP | -0.55 |
| TPSA | 71.33 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 168.15 |
| LogP ≤ 5 | -0.55 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide?
The IUPAC name of 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide (CID 59149002) is 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide.
What is the SMILES notation for 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide?
The canonical SMILES for 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide is CNC(=O)c1cccc(=O)n1O.
What is the InChIKey of 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide?
The InChIKey is PEALCMWAXXMUSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O3/c1-8-7(11)5-3-2-4-6(10)9(5)12/h2-4,12H,1H3,(H,8,11).
What are the key properties of 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide?
1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide has a molecular weight of 168.15 g/mol, XLogP of -0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide is sourced from PubChem (CID 59149002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).