N,1-dihydroxy-6-oxopyridine-2-carboxamide

C6H6N2O4 — CID 118717069

IUPACN,1-dihydroxy-6-oxopyridine-2-carboxamide
SMILESO=C(NO)c1cccc(=O)n1O
InChIInChI=1S/C6H6N2O4/c9-5-3-1-2-4(8(5)12)6(10)7-11/h1-3,11-12H,(H,7,10)
InChIKeyCZVPFUHVAAJNNN-UHFFFAOYSA-N
MW170.12 g/mol
LogP-0.80
Rot. Bonds1

About N,1-dihydroxy-6-oxopyridine-2-carboxamide

N,1-dihydroxy-6-oxopyridine-2-carboxamide (PubChem CID 118717069) has the molecular formula C6H6N2O4 and a molecular weight of 170.12 g/mol. Its IUPAC name is N,1-dihydroxy-6-oxopyridine-2-carboxamide.

Molecular Properties

Compound NameN,1-dihydroxy-6-oxopyridine-2-carboxamide
PubChem CID118717069
Molecular FormulaC6H6N2O4
Molecular Weight170.12 g/mol
Exact Mass170.03
IUPAC NameN,1-dihydroxy-6-oxopyridine-2-carboxamide
SMILESO=C(NO)c1cccc(=O)n1O
InChIInChI=1S/C6H6N2O4/c9-5-3-1-2-4(8(5)12)6(10)7-11/h1-3,11-12H,(H,7,10)
InChIKeyCZVPFUHVAAJNNN-UHFFFAOYSA-N
XLogP-0.80
TPSA91.56 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.12
LogP ≤ 5-0.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-Hydroxy-6-oxopyridine-2-carboxamide
CID 19780055
1-Fluoro-6-oxopyridine-2-carboxamide
CID 174852171
6-Hydroxypicolinamide
CID 18327802
1-hydroxy-N-methyl-6-oxopyridine-2-carboxamide
CID 59149002
N-hydroxy-6-oxo-1H-pyridine-2-carboxamide
CID 108108361
molecular hydrogen;6-oxo-1H-pyridine-2-carboxamide
CID 145371038
1-hydroxy-2H-pyridine-6-carboxamide
CID 153522538
N-iodo-6-oxo-1H-pyridine-2-carboxamide
CID 170233885
1-Chloro-6-oxopyridine-2-carboxamide
CID 174852258
N-methoxy-6-oxo-1H-pyridine-2-carboxamide
CID 107261667
1-hydroxy-N-methoxy-6-oxopyridine-2-carboxamide
CID 131132305

Frequently Asked Questions

What is the IUPAC name of N,1-dihydroxy-6-oxopyridine-2-carboxamide?
The IUPAC name of N,1-dihydroxy-6-oxopyridine-2-carboxamide (CID 118717069) is N,1-dihydroxy-6-oxopyridine-2-carboxamide.
What is the SMILES notation for N,1-dihydroxy-6-oxopyridine-2-carboxamide?
The canonical SMILES for N,1-dihydroxy-6-oxopyridine-2-carboxamide is O=C(NO)c1cccc(=O)n1O.
What is the InChIKey of N,1-dihydroxy-6-oxopyridine-2-carboxamide?
The InChIKey is CZVPFUHVAAJNNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N2O4/c9-5-3-1-2-4(8(5)12)6(10)7-11/h1-3,11-12H,(H,7,10).
What are the key properties of N,1-dihydroxy-6-oxopyridine-2-carboxamide?
N,1-dihydroxy-6-oxopyridine-2-carboxamide has a molecular weight of 170.12 g/mol, XLogP of -0.80, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dihydroxy-6-oxopyridine-2-carboxamide is sourced from PubChem (CID 118717069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).