N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide

C20H18ClN3O2 — CID 109244720

IUPACN-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide
SMILESCOc1ccccc1Nc1cncc(C(=O)Nc2cc(Cl)ccc2C)c1
InChIInChI=1S/C20H18ClN3O2/c1-13-7-8-15(21)10-18(13)24-20(25)14-9-16(12-22-11-14)23-17-5-3-4-6-19(17)26-2/h3-12,23H,1-2H3,(H,24,25)
InChIKeyJKDGXPLPGVOTTM-UHFFFAOYSA-N
MW367.84 g/mol
LogP5.05
Rot. Bonds5

About N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide

N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide (PubChem CID 109244720) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide
PubChem CID109244720
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC NameN-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide
SMILESCOc1ccccc1Nc1cncc(C(=O)Nc2cc(Cl)ccc2C)c1
InChIInChI=1S/C20H18ClN3O2/c1-13-7-8-15(21)10-18(13)24-20(25)14-9-16(12-22-11-14)23-17-5-3-4-6-19(17)26-2/h3-12,23H,1-2H3,(H,24,25)
InChIKeyJKDGXPLPGVOTTM-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-(2,3-dimethylanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109243291
N-(2-chloro-4,6-dimethylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide
CID 109244973
5-(4-chloroanilino)-N-(5-chloro-2-methoxyphenyl)pyridine-3-carboxamide
CID 109244615
5-(5-chloro-2-methylanilino)-N-(4-chlorophenyl)pyridine-3-carboxamide
CID 109244563
N-(2-methoxyphenyl)-5-(2,4,6-trimethylanilino)pyridine-3-carboxamide
CID 109243927
5-(2,4-dimethoxyanilino)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 109245108
N-(2-methoxyphenyl)-5-(4-methylanilino)pyridine-3-carboxamide
CID 109242131
5-(5-chloro-2-methoxyanilino)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109245063
5-(5-chloro-2-methoxyanilino)-N-(2-phenylethyl)pyridine-3-carboxamide
CID 109235843
5-(5-chloro-2-methoxyanilino)-N-(3-fluorophenyl)pyridine-3-carboxamide
CID 109245070
N-(2-chlorophenyl)-5-(2,5-dimethoxyanilino)pyridine-3-carboxamide
CID 109244383
5-(5-chloro-2-methylanilino)-N-propan-2-ylpyridine-3-carboxamide
CID 109223277

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide (CID 109244720) is N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide is COc1ccccc1Nc1cncc(C(=O)Nc2cc(Cl)ccc2C)c1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide?
The InChIKey is JKDGXPLPGVOTTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-13-7-8-15(21)10-18(13)24-20(25)14-9-16(12-22-11-14)23-17-5-3-4-6-19(17)26-2/h3-12,23H,1-2H3,(H,24,25).
What are the key properties of N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide?
N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)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 N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109244720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).