6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide

C13H11ClN2O3 — CID 62234559

IUPAC6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cccc(Cl)n2)cc1O
InChIInChI=1S/C13H11ClN2O3/c1-19-11-6-5-8(7-10(11)17)15-13(18)9-3-2-4-12(14)16-9/h2-7,17H,1H3,(H,15,18)
InChIKeyULPOVPLTFRXWQX-UHFFFAOYSA-N
MW278.70 g/mol
LogP2.70
Rot. Bonds3

About 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide

6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide (PubChem CID 62234559) has the molecular formula C13H11ClN2O3 and a molecular weight of 278.70 g/mol. Its IUPAC name is 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide
PubChem CID62234559
Molecular FormulaC13H11ClN2O3
Molecular Weight278.70 g/mol
Exact Mass278.05
IUPAC Name6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cccc(Cl)n2)cc1O
InChIInChI=1S/C13H11ClN2O3/c1-19-11-6-5-8(7-10(11)17)15-13(18)9-3-2-4-12(14)16-9/h2-7,17H,1H3,(H,15,18)
InChIKeyULPOVPLTFRXWQX-UHFFFAOYSA-N
XLogP2.70
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.70
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-4-carboxamide
CID 60693051
6-[(3-chloro-4-methoxyphenyl)carbamoyl]pyridine-2-carboxylic acid
CID 43558305
6-bromo-N-(3-chloro-4-methoxyphenyl)pyridine-2-carboxamide
CID 113343016
methyl 5-[(6-chloropyridine-2-carbonyl)amino]-2-fluorobenzoate
CID 62235265
2-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-3-carboxamide
CID 60637342
2-N,6-N-bis(3,4-dihydroxyphenyl)pyridine-2,6-dicarboxamide
CID 136863629
6-chloro-N-(3-chloro-4-propoxyphenyl)pyridine-2-carboxamide
CID 62234356
N-(3-hydroxy-4-methoxyphenyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 103600732
6-N-tert-butyl-2-N-(3,4-dimethoxyphenyl)pyridine-2,6-dicarboxamide
CID 109099186
N-(3-acetamido-4-methylphenyl)-6-chloropyridine-2-carboxamide
CID 62235289
6-chloro-N-(3-iodophenyl)pyridine-2-carboxamide
CID 55052347
N-[3-(carbamoylamino)phenyl]-6-chloropyridine-2-carboxamide
CID 62234924

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide (CID 62234559) is 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide is COc1ccc(NC(=O)c2cccc(Cl)n2)cc1O.
What is the InChIKey of 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide?
The InChIKey is ULPOVPLTFRXWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O3/c1-19-11-6-5-8(7-10(11)17)15-13(18)9-3-2-4-12(14)16-9/h2-7,17H,1H3,(H,15,18).
What are the key properties of 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide?
6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide has a molecular weight of 278.70 g/mol, XLogP of 2.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-hydroxy-4-methoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 62234559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).