N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide

C19H23N3O2 — CID 109020641

IUPACN-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide
SMILESCC(=O)Nc1ccc(NC(=O)CCN(C)Cc2ccccc2)cc1
InChIInChI=1S/C19H23N3O2/c1-15(23)20-17-8-10-18(11-9-17)21-19(24)12-13-22(2)14-16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyNPHQSSXVKIQZPD-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.11
Rot. Bonds7

About N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide

N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide (PubChem CID 109020641) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide
PubChem CID109020641
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide
SMILESCC(=O)Nc1ccc(NC(=O)CCN(C)Cc2ccccc2)cc1
InChIInChI=1S/C19H23N3O2/c1-15(23)20-17-8-10-18(11-9-17)21-19(24)12-13-22(2)14-16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyNPHQSSXVKIQZPD-UHFFFAOYSA-N
XLogP3.11
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide 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

3-[benzyl(methyl)amino]-N-(4-chlorophenyl)propanamide
CID 882844
3-[benzyl(methyl)amino]-N-(4-bromophenyl)propanamide;hydrochloride
CID 90483527
3-[benzyl(methyl)amino]-N-(4-cyanophenyl)propanamide
CID 28792972
3-[acetyl(benzyl)amino]-N-(4-fluorophenyl)propanamide
CID 113118291
3-[benzyl(methyl)amino]-N-(3-chloro-4-methylphenyl)propanamide
CID 109020626
3-[(3-anilino-3-oxopropyl)-methylamino]propanoic acid
CID 60987692
3-[benzyl(methyl)amino]-N-(3-chlorophenyl)propanamide;oxalic acid
CID 171154533
3-[benzyl(methyl)amino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 17397146
N-[4-(benzylamino)phenyl]-3-(dimethylamino)propanamide
CID 141036674
N-(4-acetylphenyl)-3-[benzyl(propan-2-yl)amino]propanamide
CID 109031834
3-[benzyl(methylsulfonyl)amino]-N-(4-fluorophenyl)propanamide
CID 113138694
N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide
CID 55850747

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide?
The IUPAC name of N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide (CID 109020641) is N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide.
What is the SMILES notation for N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide?
The canonical SMILES for N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide is CC(=O)Nc1ccc(NC(=O)CCN(C)Cc2ccccc2)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide?
The InChIKey is NPHQSSXVKIQZPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-15(23)20-17-8-10-18(11-9-17)21-19(24)12-13-22(2)14-16-6-4-3-5-7-16/h3-11H,12-14H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide?
N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide has a molecular weight of 325.41 g/mol, XLogP of 3.11, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide is sourced from PubChem (CID 109020641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).