N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide

C21H18ClN3O3 — CID 109221420

IUPACN-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide
SMILESCOc1ccc(Cl)cc1Nc1ccnc(C(=O)Nc2cccc(C(C)=O)c2)c1
InChIInChI=1S/C21H18ClN3O3/c1-13(26)14-4-3-5-16(10-14)25-21(27)19-12-17(8-9-23-19)24-18-11-15(22)6-7-20(18)28-2/h3-12H,1-2H3,(H,23,24)(H,25,27)
InChIKeyGOMCFASNTIOCSF-UHFFFAOYSA-N
MW395.85 g/mol
LogP4.94
Rot. Bonds6

About N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide

N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide (PubChem CID 109221420) has the molecular formula C21H18ClN3O3 and a molecular weight of 395.85 g/mol. Its IUPAC name is N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide
PubChem CID109221420
Molecular FormulaC21H18ClN3O3
Molecular Weight395.85 g/mol
Exact Mass395.10
IUPAC NameN-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide
SMILESCOc1ccc(Cl)cc1Nc1ccnc(C(=O)Nc2cccc(C(C)=O)c2)c1
InChIInChI=1S/C21H18ClN3O3/c1-13(26)14-4-3-5-16(10-14)25-21(27)19-12-17(8-9-23-19)24-18-11-15(22)6-7-20(18)28-2/h3-12H,1-2H3,(H,23,24)(H,25,27)
InChIKeyGOMCFASNTIOCSF-UHFFFAOYSA-N
XLogP4.94
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.85
LogP ≤ 54.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-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-(3-acetylphenyl)-5-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide
CID 109199643
N-(3-acetylphenyl)-4-(3,4-dimethoxyanilino)pyridine-2-carboxamide
CID 109222033
4-(4-acetylanilino)-N-(5-chloro-2-methoxyphenyl)pyridine-2-carboxamide
CID 109221402
4-(5-chloro-2-methoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109221419
4-(2,5-dimethoxyanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109221555
5-(3-acetylanilino)-N-(5-chloro-2-methoxyphenyl)pyrazine-2-carboxamide
CID 109293322
N-(3-acetylphenyl)-4-anilinopyridine-2-carboxamide
CID 109218881
methyl 3-[[4-(3-chloroanilino)pyridine-2-carbonyl]amino]benzoate
CID 109220998
N-(4-chloro-2-methylphenyl)-4-(2-methoxyanilino)pyridine-2-carboxamide
CID 109221193
methyl 3-[[4-(4-acetylanilino)pyridine-2-carbonyl]amino]benzoate
CID 109222174
4-(5-chloro-2-methoxyanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109204841
methyl 3-[[2-[(5-chloro-2-methylphenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109221158

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide (CID 109221420) is N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide is COc1ccc(Cl)cc1Nc1ccnc(C(=O)Nc2cccc(C(C)=O)c2)c1.
What is the InChIKey of N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide?
The InChIKey is GOMCFASNTIOCSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClN3O3/c1-13(26)14-4-3-5-16(10-14)25-21(27)19-12-17(8-9-23-19)24-18-11-15(22)6-7-20(18)28-2/h3-12H,1-2H3,(H,23,24)(H,25,27).
What are the key properties of N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide?
N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide has a molecular weight of 395.85 g/mol, XLogP of 4.94, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-4-(5-chloro-2-methoxyanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109221420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).