6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide

C20H18ClN3O2 — CID 109162100

IUPAC6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)c1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C20H18ClN3O2/c1-13-10-17(18(26-2)11-16(13)21)24-20(25)14-8-9-19(22-12-14)23-15-6-4-3-5-7-15/h3-12H,1-2H3,(H,22,23)(H,24,25)
InChIKeyKOROLZUQEPLFAN-UHFFFAOYSA-N
MW367.84 g/mol
LogP5.05
Rot. Bonds5

About 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide

6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide (PubChem CID 109162100) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide
PubChem CID109162100
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC Name6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)c1ccc(Nc2ccccc2)nc1
InChIInChI=1S/C20H18ClN3O2/c1-13-10-17(18(26-2)11-16(13)21)24-20(25)14-8-9-19(22-12-14)23-15-6-4-3-5-7-15/h3-12H,1-2H3,(H,22,23)(H,24,25)
InChIKeyKOROLZUQEPLFAN-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

6-(4-chloro-2-methoxy-5-methylanilino)-N-phenylpyridine-3-carboxamide
CID 109162131
6-(4-chloro-2-methoxy-5-methylanilino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109163247
6-(4-chloro-2-methoxy-5-methylanilino)-N-(3-methoxyphenyl)pyridine-3-carboxamide
CID 109164004
N-(4-chloro-2-methoxy-5-methylphenyl)-6-(2-methoxyethylamino)pyridine-3-carboxamide
CID 109152976
N-(4-chloro-2-methoxy-5-methylphenyl)-6-(N-methylanilino)pyridine-3-carboxamide
CID 109162350
6-(butylamino)-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109151665
N-(2-chlorophenyl)-6-(3,4-dimethoxyanilino)pyridine-3-carboxamide
CID 109163378
6-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopentylpyridine-3-carboxamide
CID 109152287
N-(4-chloro-2-methoxy-5-methylphenyl)-3-methoxy-4-methylbenzamide
CID 9083792
2-(4-chloro-2-methoxy-5-methylanilino)-N-(2-methylphenyl)pyrimidine-5-carboxamide
CID 109265367
6-(2-chloroanilino)-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
CID 109163334
N-phenyl-6-(3,4,5-trimethoxyanilino)pyridine-3-carboxamide
CID 109162123

Frequently Asked Questions

What is the IUPAC name of 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide (CID 109162100) is 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide is COc1cc(Cl)c(C)cc1NC(=O)c1ccc(Nc2ccccc2)nc1.
What is the InChIKey of 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The InChIKey is KOROLZUQEPLFAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-13-10-17(18(26-2)11-16(13)21)24-20(25)14-8-9-19(22-12-14)23-15-6-4-3-5-7-15/h3-12H,1-2H3,(H,22,23)(H,24,25).
What are the key properties of 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-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 6-anilino-N-(4-chloro-2-methoxy-5-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109162100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).