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

C14H14ClN3O2 — CID 62167485

IUPAC2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)Nc2cccc(OC)c2)cc(Cl)n1
InChIInChI=1S/C14H14ClN3O2/c1-16-13-7-9(6-12(15)18-13)14(19)17-10-4-3-5-11(8-10)20-2/h3-8H,1-2H3,(H,16,18)(H,17,19)
InChIKeyOYIWVFLIMAVUJS-UHFFFAOYSA-N
MW291.74 g/mol
LogP3.04
Rot. Bonds4

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

2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide (PubChem CID 62167485) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide
PubChem CID62167485
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide
SMILESCNc1cc(C(=O)Nc2cccc(OC)c2)cc(Cl)n1
InChIInChI=1S/C14H14ClN3O2/c1-16-13-7-9(6-12(15)18-13)14(19)17-10-4-3-5-11(8-10)20-2/h3-8H,1-2H3,(H,16,18)(H,17,19)
InChIKeyOYIWVFLIMAVUJS-UHFFFAOYSA-N
XLogP3.04
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-6-(methylamino)-N-phenylpyridine-4-carboxamide
CID 55042308
N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 55042566
2-chloro-6-(methylamino)-N-(2-methyl-4-pyridinyl)pyridine-4-carboxamide
CID 78954355
2-chloro-N-(4-fluoro-3-methylphenyl)-6-(methylamino)pyridine-4-carboxamide
CID 62811586
3,5-diacetamido-N-(3-methoxyphenyl)benzamide
CID 18104274
3-N-(3-methoxyphenyl)-1-N-(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057620
N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104640036
2-N,5-N-bis(3-methoxyphenyl)pyridine-2,5-dicarboxamide
CID 1368781
2-chloro-N-(2-chloro-6-methylphenyl)-6-(methylamino)pyridine-4-carboxamide
CID 66255648
2-chloro-N-(2,3-dimethylphenyl)-6-(methylamino)pyridine-4-carboxamide
CID 62166263
2-chloro-6-(ethylamino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 62171252
6-N-(3-methoxyphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099989

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide?
The IUPAC name of 2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide (CID 62167485) is 2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide?
The canonical SMILES for 2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide is CNc1cc(C(=O)Nc2cccc(OC)c2)cc(Cl)n1.
What is the InChIKey of 2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide?
The InChIKey is OYIWVFLIMAVUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-16-13-7-9(6-12(15)18-13)14(19)17-10-4-3-5-11(8-10)20-2/h3-8H,1-2H3,(H,16,18)(H,17,19).
What are the key properties of 2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide?
2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide has a molecular weight of 291.74 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide is sourced from PubChem (CID 62167485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).