5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide

C21H19N3O2 — CID 109197604

IUPAC5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide
SMILESCC(=O)c1ccc(Nc2ccc(C(=O)N(C)c3ccccc3)nc2)cc1
InChIInChI=1S/C21H19N3O2/c1-15(25)16-8-10-17(11-9-16)23-18-12-13-20(22-14-18)21(26)24(2)19-6-4-3-5-7-19/h3-14,23H,1-2H3
InChIKeyZOYISSHQNDPUCS-UHFFFAOYSA-N
MW345.40 g/mol
LogP4.30
Rot. Bonds5

About 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide

5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide (PubChem CID 109197604) has the molecular formula C21H19N3O2 and a molecular weight of 345.40 g/mol. Its IUPAC name is 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide
PubChem CID109197604
Molecular FormulaC21H19N3O2
Molecular Weight345.40 g/mol
Exact Mass345.15
IUPAC Name5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide
SMILESCC(=O)c1ccc(Nc2ccc(C(=O)N(C)c3ccccc3)nc2)cc1
InChIInChI=1S/C21H19N3O2/c1-15(25)16-8-10-17(11-9-16)23-18-12-13-20(22-14-18)21(26)24(2)19-6-4-3-5-7-19/h3-14,23H,1-2H3
InChIKeyZOYISSHQNDPUCS-UHFFFAOYSA-N
XLogP4.30
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-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

methyl 4-[[6-[methyl(phenyl)carbamoyl]-3-pyridinyl]amino]benzoate
CID 109197609
5-(4-acetylanilino)-N-ethyl-N-phenylpyridine-2-carboxamide
CID 109198507
5-(3,5-dimethylanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197567
5-(3,5-dichloroanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197632
N-methyl-N-phenyl-5-(2-propan-2-ylanilino)pyridine-2-carboxamide
CID 109197573
N-methyl-N-phenyl-5-(propylamino)pyridine-2-carboxamide
CID 109179331
5-(2-ethoxyanilino)-N-methyl-N-phenylpyridine-2-carboxamide
CID 109197592
5-[2-(dimethylamino)ethylamino]-N-methyl-N-phenylpyridine-2-carboxamide
CID 109185536
methyl 4-[[5-[methyl(phenyl)carbamoyl]pyrazin-2-yl]amino]benzoate
CID 109290259
5-(3-acetylanilino)-N-ethyl-N-phenylpyridine-2-carboxamide
CID 109198506
N-methyl-5-[(2-methylphenyl)methylamino]-N-phenylpyridine-2-carboxamide
CID 109188298
N-methyl-N-phenyl-5-(pyridin-4-ylmethylamino)pyridine-2-carboxamide
CID 109191642

Frequently Asked Questions

What is the IUPAC name of 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide?
The IUPAC name of 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide (CID 109197604) is 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide.
What is the SMILES notation for 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide?
The canonical SMILES for 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide is CC(=O)c1ccc(Nc2ccc(C(=O)N(C)c3ccccc3)nc2)cc1.
What is the InChIKey of 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide?
The InChIKey is ZOYISSHQNDPUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O2/c1-15(25)16-8-10-17(11-9-16)23-18-12-13-20(22-14-18)21(26)24(2)19-6-4-3-5-7-19/h3-14,23H,1-2H3.
What are the key properties of 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide?
5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide has a molecular weight of 345.40 g/mol, XLogP of 4.30, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-acetylanilino)-N-methyl-N-phenylpyridine-2-carboxamide is sourced from PubChem (CID 109197604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).