2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide

C22H22N4O2 — CID 109176712

IUPAC2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide
SMILESCC(=O)Nc1cccc(Nc2cc(C(=O)Nc3cc(C)cc(C)c3)ccn2)c1
InChIInChI=1S/C22H22N4O2/c1-14-9-15(2)11-20(10-14)26-22(28)17-7-8-23-21(12-17)25-19-6-4-5-18(13-19)24-16(3)27/h4-13H,1-3H3,(H,23,25)(H,24,27)(H,26,28)
InChIKeyQARXPCLWOAJVPP-UHFFFAOYSA-N
MW374.44 g/mol
LogP4.65
Rot. Bonds5

About 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide

2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide (PubChem CID 109176712) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide
PubChem CID109176712
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC Name2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide
SMILESCC(=O)Nc1cccc(Nc2cc(C(=O)Nc3cc(C)cc(C)c3)ccn2)c1
InChIInChI=1S/C22H22N4O2/c1-14-9-15(2)11-20(10-14)26-22(28)17-7-8-23-21(12-17)25-19-6-4-5-18(13-19)24-16(3)27/h4-13H,1-3H3,(H,23,25)(H,24,27)(H,26,28)
InChIKeyQARXPCLWOAJVPP-UHFFFAOYSA-N
XLogP4.65
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 54.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-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-(3-acetamidoanilino)-N-(2,4,6-trimethylphenyl)pyridine-4-carboxamide
CID 109177121
2-(3-acetamidoanilino)-N-(2,6-dimethylphenyl)pyridine-4-carboxamide
CID 109176756
methyl 3-[[4-[(3,5-dimethylphenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109176715
N-(3-acetamidophenyl)-2-(4-acetylanilino)pyridine-4-carboxamide
CID 109178526
N-(3-bromophenyl)-2-(3-methylanilino)pyridine-4-carboxamide
CID 109176276
2-(3-acetamidoanilino)-N-(4-methoxyphenyl)pyridine-4-carboxamide
CID 109178041
2-(3-acetamidoanilino)-N-(3-cyanophenyl)pyridine-4-carboxamide
CID 109178564
2-(4-acetamidoanilino)-N-(4-methylphenyl)pyridine-4-carboxamide
CID 109176294
N-(3-acetamidophenyl)-6-(3,5-dimethylanilino)pyridine-3-carboxamide
CID 109162684
N-(3,5-dimethylphenyl)-2-(methylamino)pyridine-4-carboxamide
CID 62167632
2-(3-acetamidoanilino)-N-(2-methoxyphenyl)pyridine-4-carboxamide
CID 109177884
N-(3-acetamidophenyl)-2-bromopyridine-4-carboxamide
CID 71854176

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide (CID 109176712) is 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide is CC(=O)Nc1cccc(Nc2cc(C(=O)Nc3cc(C)cc(C)c3)ccn2)c1.
What is the InChIKey of 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide?
The InChIKey is QARXPCLWOAJVPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-14-9-15(2)11-20(10-14)26-22(28)17-7-8-23-21(12-17)25-19-6-4-5-18(13-19)24-16(3)27/h4-13H,1-3H3,(H,23,25)(H,24,27)(H,26,28).
What are the key properties of 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide?
2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 4.65, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetamidoanilino)-N-(3,5-dimethylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 109176712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).