N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide

C13H11N3O3 — CID 137104191

IUPACN-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(N/N=C\c1ccccc1O)c1ccc[nH]c1=O
InChIInChI=1S/C13H11N3O3/c17-11-6-2-1-4-9(11)8-15-16-13(19)10-5-3-7-14-12(10)18/h1-8,17H,(H,14,18)(H,16,19)/b15-8-
InChIKeyGJLFQWKRTDBWFS-NVNXTCNLSA-N
MW257.25 g/mol
LogP0.84
Rot. Bonds3

About N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide

N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 137104191) has the molecular formula C13H11N3O3 and a molecular weight of 257.25 g/mol. Its IUPAC name is N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide
PubChem CID137104191
Molecular FormulaC13H11N3O3
Molecular Weight257.25 g/mol
Exact Mass257.08
IUPAC NameN-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide
SMILESO=C(N/N=C\c1ccccc1O)c1ccc[nH]c1=O
InChIInChI=1S/C13H11N3O3/c17-11-6-2-1-4-9(11)8-15-16-13(19)10-5-3-7-14-12(10)18/h1-8,17H,(H,14,18)(H,16,19)/b15-8-
InChIKeyGJLFQWKRTDBWFS-NVNXTCNLSA-N
XLogP0.84
TPSA94.55 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.25
LogP ≤ 50.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 139163644
N-[(2-hydroxyphenyl)methylideneamino]-6-oxo-1H-pyrimidine-5-carboxamide
CID 3641500
N-[(2-hydroxyphenyl)methylideneamino]-2-(methylamino)benzamide
CID 3596715
N-[(Z)-(2-hydroxyphenyl)methylideneamino]-1H-indole-3-carboxamide
CID 136661289
N-[(E)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-quinoline-4-carboxamide
CID 135492206
N-[(2-hydroxyphenyl)methylideneamino]-2-methoxybenzamide
CID 3470891
3,5-dihydroxy-N-[(Z)-(2-hydroxyphenyl)methylideneamino]benzamide
CID 135708473
4-bromo-2-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]benzamide
CID 135511246
2-hydroxy-N-[(Z)-(2-methylphenyl)methylideneamino]benzamide
CID 5392167
N-[(2-fluorophenyl)methylideneamino]-2-hydroxybenzamide
CID 674709
2-hydroxy-N-[[2-hydroxy-5-[[4-hydroxy-3-[[(2-hydroxybenzoyl)hydrazinylidene]methyl]phenyl]methyl]phenyl]methylideneamino]benzamide
CID 4531044
[(Z)-(2-hydroxyphenyl)methylideneamino]urea
CID 135741564

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide (CID 137104191) is N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide is O=C(N/N=C\c1ccccc1O)c1ccc[nH]c1=O.
What is the InChIKey of N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is GJLFQWKRTDBWFS-NVNXTCNLSA-N. The full InChI is InChI=1S/C13H11N3O3/c17-11-6-2-1-4-9(11)8-15-16-13(19)10-5-3-7-14-12(10)18/h1-8,17H,(H,14,18)(H,16,19)/b15-8-.
What are the key properties of N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide?
N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 257.25 g/mol, XLogP of 0.84, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(2-hydroxyphenyl)methylideneamino]-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 137104191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).