5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide

C20H18ClN3O2 — CID 109199489

IUPAC5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(Nc3ccc(C)c(Cl)c3)cn2)c1
InChIInChI=1S/C20H18ClN3O2/c1-13-6-7-15(11-18(13)21)23-16-8-9-19(22-12-16)20(25)24-14-4-3-5-17(10-14)26-2/h3-12,23H,1-2H3,(H,24,25)
InChIKeySKWTUWXOHSLZGB-UHFFFAOYSA-N
MW367.84 g/mol
LogP5.05
Rot. Bonds5

About 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide

5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide (PubChem CID 109199489) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
PubChem CID109199489
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC Name5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(Nc3ccc(C)c(Cl)c3)cn2)c1
InChIInChI=1S/C20H18ClN3O2/c1-13-6-7-15(11-18(13)21)23-16-8-9-19(22-12-16)20(25)24-14-4-3-5-17(10-14)26-2/h3-12,23H,1-2H3,(H,24,25)
InChIKeySKWTUWXOHSLZGB-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

4-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109221266
5-(3-acetamidoanilino)-N-(3-chloro-4-methylphenyl)pyridine-2-carboxamide
CID 109199474
N-(3-chloro-4-methylphenyl)-2-(3-methoxyanilino)pyrimidine-5-carboxamide
CID 109269147
5-(3-acetamidoanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199786
5-(3,4-difluoroanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199817
N-(3-chloro-4-methylphenyl)-2-(3-methoxyanilino)pyrimidine-4-carboxamide
CID 109317290
5-(3-chloro-4-methylanilino)-N-[2-(3-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109192640
5-(3-fluoroanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199794
5-(3-methoxyanilino)-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
CID 109198726
methyl 4-[[6-[(3-chloro-4-methylphenyl)carbamoyl]-3-pyridinyl]amino]benzoate
CID 109199478
N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104640036
N-(3,4-dimethylphenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
CID 109290986

Frequently Asked Questions

What is the IUPAC name of 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide (CID 109199489) is 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide is COc1cccc(NC(=O)c2ccc(Nc3ccc(C)c(Cl)c3)cn2)c1.
What is the InChIKey of 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide?
The InChIKey is SKWTUWXOHSLZGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-13-6-7-15(11-18(13)21)23-16-8-9-19(22-12-16)20(25)24-14-4-3-5-17(10-14)26-2/h3-12,23H,1-2H3,(H,24,25).
What are the key properties of 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide?
5-(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 5-(3-chloro-4-methylanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109199489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).