N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide

C22H22N4O2 — CID 109158260

IUPACN-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccc(NCCc3ccccc3)nc2)c1
InChIInChI=1S/C22H22N4O2/c1-16(27)25-19-8-5-9-20(14-19)26-22(28)18-10-11-21(24-15-18)23-13-12-17-6-3-2-4-7-17/h2-11,14-15H,12-13H2,1H3,(H,23,24)(H,25,27)(H,26,28)
InChIKeyFFHMDADRJRPVGJ-UHFFFAOYSA-N
MW374.44 g/mol
LogP3.95
Rot. Bonds7

About N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide

N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide (PubChem CID 109158260) has the molecular formula C22H22N4O2 and a molecular weight of 374.44 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
PubChem CID109158260
Molecular FormulaC22H22N4O2
Molecular Weight374.44 g/mol
Exact Mass374.17
IUPAC NameN-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
SMILESCC(=O)Nc1cccc(NC(=O)c2ccc(NCCc3ccccc3)nc2)c1
InChIInChI=1S/C22H22N4O2/c1-16(27)25-19-8-5-9-20(14-19)26-22(28)18-10-11-21(24-15-18)23-13-12-17-6-3-2-4-7-17/h2-11,14-15H,12-13H2,1H3,(H,23,24)(H,25,27)(H,26,28)
InChIKeyFFHMDADRJRPVGJ-UHFFFAOYSA-N
XLogP3.95
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.44
LogP ≤ 53.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(3-acetamidophenyl)-6-(2-phenylethylamino)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-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158234
N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160811
N-phenyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160785
N-(3-acetamidophenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109153216
N-(3-methoxyphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160801
N-(3-chlorophenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160796
N-(3-acetamidophenyl)-6-[3-(dimethylamino)propylamino]pyridine-3-carboxamide
CID 109154328
N-(1,3-benzodioxol-5-yl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158270
3,4-dimethyl-N-[6-(2-phenylethylamino)-3-pyridinyl]benzamide
CID 113013026
N-(3-acetylphenyl)-2-(2-phenylethylamino)pyrimidine-5-carboxamide
CID 109259587
N-(3-acetylphenyl)-5-(2-phenylethylamino)pyrazine-2-carboxamide
CID 109283988
N-(4-acetamidophenyl)-2-(2-phenylethylamino)pyrimidine-5-carboxamide
CID 109259590

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide (CID 109158260) is N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide is CC(=O)Nc1cccc(NC(=O)c2ccc(NCCc3ccccc3)nc2)c1.
What is the InChIKey of N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide?
The InChIKey is FFHMDADRJRPVGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O2/c1-16(27)25-19-8-5-9-20(14-19)26-22(28)18-10-11-21(24-15-18)23-13-12-17-6-3-2-4-7-17/h2-11,14-15H,12-13H2,1H3,(H,23,24)(H,25,27)(H,26,28).
What are the key properties of N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide?
N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide has a molecular weight of 374.44 g/mol, XLogP of 3.95, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109158260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).