N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide

C21H20ClN3O2 — CID 109244724

IUPACN-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccc(Nc2cncc(C(=O)Nc3cc(Cl)ccc3C)c2)cc1
InChIInChI=1S/C21H20ClN3O2/c1-3-27-19-8-6-17(7-9-19)24-18-10-15(12-23-13-18)21(26)25-20-11-16(22)5-4-14(20)2/h4-13,24H,3H2,1-2H3,(H,25,26)
InChIKeyJDMOLHNZFSJBNX-UHFFFAOYSA-N
MW381.86 g/mol
LogP5.44
Rot. Bonds6

About N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide

N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide (PubChem CID 109244724) has the molecular formula C21H20ClN3O2 and a molecular weight of 381.86 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
PubChem CID109244724
Molecular FormulaC21H20ClN3O2
Molecular Weight381.86 g/mol
Exact Mass381.12
IUPAC NameN-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccc(Nc2cncc(C(=O)Nc3cc(Cl)ccc3C)c2)cc1
InChIInChI=1S/C21H20ClN3O2/c1-3-27-19-8-6-17(7-9-19)24-18-10-15(12-23-13-18)21(26)25-20-11-16(22)5-4-14(20)2/h4-13,24H,3H2,1-2H3,(H,25,26)
InChIKeyJDMOLHNZFSJBNX-UHFFFAOYSA-N
XLogP5.44
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.86
LogP ≤ 55.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-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

N-(2,4-difluorophenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109245490
N-[(4-chlorophenyl)methyl]-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109234037
5-(4-ethoxyanilino)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109245293
2-(5-chloro-2-methylanilino)-N-(4-ethoxyphenyl)pyrimidine-5-carboxamide
CID 109269044
5-(5-chloro-2-methylanilino)-N-(4-chlorophenyl)pyridine-3-carboxamide
CID 109244563
N-(2,4-dimethoxyphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109245476
N-(4-chloro-2-methylphenyl)-2-(4-ethoxyanilino)pyrimidine-5-carboxamide
CID 109269080
5-(2-chloro-4,6-dimethylanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109244991
N-(2,4-dichlorophenyl)-5-(4-methoxyanilino)pyridine-3-carboxamide
CID 109245369
5-(2,6-dimethylanilino)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109243188
N'-(5-chloro-2-methylphenyl)-N-(4-ethoxyphenyl)oxamide
CID 45000868
N-(5-chloro-2-methylphenyl)-5-(2-methoxyanilino)pyridine-3-carboxamide
CID 109244720

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide (CID 109244724) is N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide is CCOc1ccc(Nc2cncc(C(=O)Nc3cc(Cl)ccc3C)c2)cc1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide?
The InChIKey is JDMOLHNZFSJBNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20ClN3O2/c1-3-27-19-8-6-17(7-9-19)24-18-10-15(12-23-13-18)21(26)25-20-11-16(22)5-4-14(20)2/h4-13,24H,3H2,1-2H3,(H,25,26).
What are the key properties of N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide?
N-(5-chloro-2-methylphenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide has a molecular weight of 381.86 g/mol, XLogP of 5.44, 6 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-(4-ethoxyanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109244724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).