2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide

C20H18ClN3O2 — CID 109176285

IUPAC2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(Cl)cc1Nc1cc(C(=O)Nc2ccc(C)cc2)ccn1
InChIInChI=1S/C20H18ClN3O2/c1-13-3-6-16(7-4-13)23-20(25)14-9-10-22-19(11-14)24-17-12-15(21)5-8-18(17)26-2/h3-12H,1-2H3,(H,22,24)(H,23,25)
InChIKeyODBUZVCKQHLPIC-UHFFFAOYSA-N
MW367.84 g/mol
LogP5.05
Rot. Bonds5

About 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide

2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide (PubChem CID 109176285) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide
PubChem CID109176285
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC Name2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide
SMILESCOc1ccc(Cl)cc1Nc1cc(C(=O)Nc2ccc(C)cc2)ccn1
InChIInChI=1S/C20H18ClN3O2/c1-13-3-6-16(7-4-13)23-20(25)14-9-10-22-19(11-14)24-17-12-15(21)5-8-18(17)26-2/h3-12H,1-2H3,(H,22,24)(H,23,25)
InChIKeyODBUZVCKQHLPIC-UHFFFAOYSA-N
XLogP5.05
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.84
LogP ≤ 55.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetylphenyl)-2-(5-chloro-2-methoxyanilino)pyridine-4-carboxamide
CID 109177842
N-(3-chloro-4-fluorophenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
CID 109177730
N-(4-ethylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
CID 109176882
2-(5-chloro-2-methoxyanilino)-N-(2-chlorophenyl)pyridine-4-carboxamide
CID 109177361
N-(4-chlorophenyl)-2-(3,4-dimethoxyanilino)pyridine-4-carboxamide
CID 109177506
N-(5-chloro-2-methoxyphenyl)-2-(3,4-difluoroanilino)pyridine-4-carboxamide
CID 109177834
2-(5-chloro-2-methoxyanilino)-N-(3-cyanophenyl)pyridine-4-carboxamide
CID 109177849
N-(2,5-dimethoxyphenyl)-2-(4-methylanilino)pyridine-4-carboxamide
CID 109176317
4-N-(4-chlorophenyl)-2-N-(2-methoxy-5-methylphenyl)pyridine-2,4-dicarboxamide
CID 109092862
N-(3-acetylphenyl)-2-(2-methoxy-5-methylanilino)pyridine-4-carboxamide
CID 109178248
6-(5-chloro-2-methoxyanilino)-N-(4-chlorophenyl)pyrimidine-4-carboxamide
CID 109358267
N-(4-acetamidophenyl)-2-(2-methoxyanilino)pyridine-4-carboxamide
CID 109177925

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide (CID 109176285) is 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide is COc1ccc(Cl)cc1Nc1cc(C(=O)Nc2ccc(C)cc2)ccn1.
What is the InChIKey of 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide?
The InChIKey is ODBUZVCKQHLPIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-13-3-6-16(7-4-13)23-20(25)14-9-10-22-19(11-14)24-17-12-15(21)5-8-18(17)26-2/h3-12H,1-2H3,(H,22,24)(H,23,25).
What are the key properties of 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide?
2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide has a molecular weight of 367.84 g/mol, XLogP of 5.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methoxyanilino)-N-(4-methylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109176285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).