4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide

C20H18ClN3O2 — CID 109221266

IUPAC4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cc(Nc3ccc(C)c(Cl)c3)ccn2)c1
InChIInChI=1S/C20H18ClN3O2/c1-13-6-7-15(11-18(13)21)23-16-8-9-22-19(12-16)20(25)24-14-4-3-5-17(10-14)26-2/h3-12H,1-2H3,(H,22,23)(H,24,25)
InChIKeyUCZCTOBQOZMJBB-UHFFFAOYSA-N
MW367.84 g/mol
LogP5.05
Rot. Bonds5

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

4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide (PubChem CID 109221266) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is 4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
PubChem CID109221266
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC Name4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cc(Nc3ccc(C)c(Cl)c3)ccn2)c1
InChIInChI=1S/C20H18ClN3O2/c1-13-6-7-15(11-18(13)21)23-16-8-9-22-19(12-16)20(25)24-14-4-3-5-17(10-14)26-2/h3-12H,1-2H3,(H,22,23)(H,24,25)
InChIKeyUCZCTOBQOZMJBB-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

5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199489
N-(3-chloro-4-methylphenyl)-2-(3-methoxyanilino)pyrimidine-4-carboxamide
CID 109317290
4-(3-methoxyanilino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109219226
4-(3-methoxyanilino)-N-phenylpyridine-2-carboxamide
CID 109218773
4-(3-chloro-4-methylanilino)-N-(2,4-dimethoxyphenyl)pyridine-2-carboxamide
CID 109221271
N-(3-chloro-4-methylphenyl)-2-(3-methoxyanilino)pyrimidine-5-carboxamide
CID 109269147
methyl 4-[[2-[(3-chloro-4-methylphenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109221255
4-(3-methoxyanilino)-N-(4-propan-2-yloxyphenyl)pyridine-2-carboxamide
CID 109221601
N-(2,4-dichlorophenyl)-4-(3-methoxyanilino)pyridine-2-carboxamide
CID 109221628
4-N-(3-chloro-4-methylphenyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092947
4-(3-chloroanilino)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109220984
4-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109221555

Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide (CID 109221266) is 4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide is COc1cccc(NC(=O)c2cc(Nc3ccc(C)c(Cl)c3)ccn2)c1.
What is the InChIKey of 4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide?
The InChIKey is UCZCTOBQOZMJBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-13-6-7-15(11-18(13)21)23-16-8-9-22-19(12-16)20(25)24-14-4-3-5-17(10-14)26-2/h3-12H,1-2H3,(H,22,23)(H,24,25).
What are the key properties of 4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide?
4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-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 4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109221266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).