N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide

C23H23N3O2 — CID 109160811

IUPACN-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2ccc(NCCCc3ccccc3)nc2)c1
InChIInChI=1S/C23H23N3O2/c1-17(27)19-10-5-11-21(15-19)26-23(28)20-12-13-22(25-16-20)24-14-6-9-18-7-3-2-4-8-18/h2-5,7-8,10-13,15-16H,6,9,14H2,1H3,(H,24,25)(H,26,28)
InChIKeyTZUCFBQSFBHCMK-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.58
Rot. Bonds8

About N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide

N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide (PubChem CID 109160811) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
PubChem CID109160811
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC NameN-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
SMILESCC(=O)c1cccc(NC(=O)c2ccc(NCCCc3ccccc3)nc2)c1
InChIInChI=1S/C23H23N3O2/c1-17(27)19-10-5-11-21(15-19)26-23(28)20-12-13-22(25-16-20)24-14-6-9-18-7-3-2-4-8-18/h2-5,7-8,10-13,15-16H,6,9,14H2,1H3,(H,24,25)(H,26,28)
InChIKeyTZUCFBQSFBHCMK-UHFFFAOYSA-N
XLogP4.58
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(3-acetylphenyl)-6-(3-phenylpropylamino)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-phenyl-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160785
N-(3-methoxyphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160801
N-(3-chlorophenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160796
N-(3-acetylphenyl)-6-(butylamino)pyridine-3-carboxamide
CID 109151637
N-(3-acetamidophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158260
N-(3-chlorophenyl)-6-(2-phenylethylamino)pyridine-3-carboxamide
CID 109158234
N-(3-acetylphenyl)-2-(2-phenylethylamino)pyrimidine-5-carboxamide
CID 109259587
N-(3-acetylphenyl)-5-(2-phenylethylamino)pyrazine-2-carboxamide
CID 109283988
N-(2-chlorophenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide
CID 109160795
N-(3-acetamidophenyl)-6-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109153216
N-(3-acetamidophenyl)-6-[3-(dimethylamino)propylamino]pyridine-3-carboxamide
CID 109154328
1-[3-[[5-(3-phenylpropylamino)-1,2,4-triazin-3-yl]amino]phenyl]ethanone
CID 112958499

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide (CID 109160811) is N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide is CC(=O)c1cccc(NC(=O)c2ccc(NCCCc3ccccc3)nc2)c1.
What is the InChIKey of N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide?
The InChIKey is TZUCFBQSFBHCMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-17(27)19-10-5-11-21(15-19)26-23(28)20-12-13-22(25-16-20)24-14-6-9-18-7-3-2-4-8-18/h2-5,7-8,10-13,15-16H,6,9,14H2,1H3,(H,24,25)(H,26,28).
What are the key properties of N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide?
N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide has a molecular weight of 373.46 g/mol, XLogP of 4.58, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-6-(3-phenylpropylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109160811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).