2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide

C20H18ClN3O2 — CID 109176346

IUPAC2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide
SMILESCOc1ccc(Nc2cc(C(=O)N(C)c3ccccc3)ccn2)cc1Cl
InChIInChI=1S/C20H18ClN3O2/c1-24(16-6-4-3-5-7-16)20(25)14-10-11-22-19(12-14)23-15-8-9-18(26-2)17(21)13-15/h3-13H,1-2H3,(H,22,23)
InChIKeyNQEUYNFQEYZWDD-UHFFFAOYSA-N
MW367.84 g/mol
LogP4.76
Rot. Bonds5

About 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide

2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide (PubChem CID 109176346) has the molecular formula C20H18ClN3O2 and a molecular weight of 367.84 g/mol. Its IUPAC name is 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide
PubChem CID109176346
Molecular FormulaC20H18ClN3O2
Molecular Weight367.84 g/mol
Exact Mass367.11
IUPAC Name2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide
SMILESCOc1ccc(Nc2cc(C(=O)N(C)c3ccccc3)ccn2)cc1Cl
InChIInChI=1S/C20H18ClN3O2/c1-24(16-6-4-3-5-7-16)20(25)14-10-11-22-19(12-14)23-15-8-9-18(26-2)17(21)13-15/h3-13H,1-2H3,(H,22,23)
InChIKeyNQEUYNFQEYZWDD-UHFFFAOYSA-N
XLogP4.76
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.84
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-chloro-2,5-dimethoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide
CID 109176377
N-(4-acetylphenyl)-2-(3-chloro-4-methoxyanilino)pyridine-4-carboxamide
CID 109177805
N-(3-chloro-4-methoxyphenyl)-2-(3-methylanilino)pyridine-4-carboxamide
CID 109176255
2-(3-chloro-4-methoxyanilino)-N-(3-fluorophenyl)pyridine-4-carboxamide
CID 109177807
N-[(2-chlorophenyl)methyl]-2-(3,4-dimethoxyanilino)pyridine-4-carboxamide
CID 109170766
2-(3-chloro-4-methoxyanilino)-N-(3-cyanophenyl)pyridine-4-carboxamide
CID 109177812
2-N-(2-methoxyphenyl)-4-N-methyl-4-N-phenylpyridine-2,4-dicarboxamide
CID 109091430
2-N-(2,5-dimethoxyphenyl)-4-N-methyl-4-N-phenylpyridine-2,4-dicarboxamide
CID 109091438
4-[[6-(3-chloro-4-methoxyanilino)pyrimidin-4-yl]amino]benzoic acid
CID 113192962
2-(cyclopropanecarbonylamino)-N-methyl-N-phenylpyridine-4-carboxamide
CID 136541713
2-(3-chloro-4-methoxyanilino)-N-(2,4-difluorophenyl)pyridine-4-carboxamide
CID 109177809
N-benzyl-6-(3-chloro-4-methoxyanilino)-N-methylpyrimidine-4-carboxamide
CID 109347955

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide?
The IUPAC name of 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide (CID 109176346) is 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide.
What is the SMILES notation for 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide?
The canonical SMILES for 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide is COc1ccc(Nc2cc(C(=O)N(C)c3ccccc3)ccn2)cc1Cl.
What is the InChIKey of 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide?
The InChIKey is NQEUYNFQEYZWDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O2/c1-24(16-6-4-3-5-7-16)20(25)14-10-11-22-19(12-14)23-15-8-9-18(26-2)17(21)13-15/h3-13H,1-2H3,(H,22,23).
What are the key properties of 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide?
2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide has a molecular weight of 367.84 g/mol, XLogP of 4.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-methoxyanilino)-N-methyl-N-phenylpyridine-4-carboxamide is sourced from PubChem (CID 109176346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).