N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide

C23H23N3O2 — CID 50829827

IUPACN-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide
SMILESCCC(=O)Nc1cccnc1-c1ccc(C(=O)Nc2cc(C)cc(C)c2)cc1
InChIInChI=1S/C23H23N3O2/c1-4-21(27)26-20-6-5-11-24-22(20)17-7-9-18(10-8-17)23(28)25-19-13-15(2)12-16(3)14-19/h5-14H,4H2,1-3H3,(H,25,28)(H,26,27)
InChIKeyCQPMHVAHOWREDY-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.97
Rot. Bonds5

About N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide

N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide (PubChem CID 50829827) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide
PubChem CID50829827
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC NameN-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide
SMILESCCC(=O)Nc1cccnc1-c1ccc(C(=O)Nc2cc(C)cc(C)c2)cc1
InChIInChI=1S/C23H23N3O2/c1-4-21(27)26-20-6-5-11-24-22(20)17-7-9-18(10-8-17)23(28)25-19-13-15(2)12-16(3)14-19/h5-14H,4H2,1-3H3,(H,25,28)(H,26,27)
InChIKeyCQPMHVAHOWREDY-UHFFFAOYSA-N
XLogP4.97
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide 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-fluorophenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide
CID 46386341
N-(3-methylbutyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide
CID 20973836
4-(3-acetamido-2-pyridinyl)-N-(3,5-dimethoxyphenyl)benzamide
CID 46386365
N-(3,5-dimethylphenyl)-4-pyridin-2-ylbenzamide
CID 143032339
4-(3-acetamido-2-pyridinyl)-N-(3-chlorophenyl)benzamide
CID 46386362
N-(3,5-dimethylphenyl)-4-(3-oxo-4-propan-2-ylpyrido[2,3-b]pyrazin-2-yl)benzamide
CID 46393790
N-[4-methyl-3-(propanoylamino)phenyl]pyridine-4-carboxamide
CID 46761053
N-(2-amino-3-pyridinyl)propanamide
CID 174521549
N-(4-pyrimidin-2-ylphenyl)propanamide
CID 137348877
N-(3,5-dimethylphenyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 110704038
N-(3-methylphenyl)-4-(3-piperidin-1-ylpyrazin-2-yl)benzamide
CID 50848199
N-[3-chloro-4-(propanoylamino)phenyl]-2-methoxypyridine-3-carboxamide
CID 50968912

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide?
The IUPAC name of N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide (CID 50829827) is N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide is CCC(=O)Nc1cccnc1-c1ccc(C(=O)Nc2cc(C)cc(C)c2)cc1.
What is the InChIKey of N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide?
The InChIKey is CQPMHVAHOWREDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-4-21(27)26-20-6-5-11-24-22(20)17-7-9-18(10-8-17)23(28)25-19-13-15(2)12-16(3)14-19/h5-14H,4H2,1-3H3,(H,25,28)(H,26,27).
What are the key properties of N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide?
N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide has a molecular weight of 373.46 g/mol, XLogP of 4.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-4-[3-(propanoylamino)-2-pyridinyl]benzamide is sourced from PubChem (CID 50829827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).