3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide

C19H21ClN2O2 — CID 879496

IUPAC3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide
SMILESCC(C)CNC(=O)c1cccc(NC(=O)Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C19H21ClN2O2/c1-13(2)12-21-19(24)15-4-3-5-17(11-15)22-18(23)10-14-6-8-16(20)9-7-14/h3-9,11,13H,10,12H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyZXUCCWOMAAIKGD-UHFFFAOYSA-N
MW344.84 g/mol
LogP3.91
Rot. Bonds6

About 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide

3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide (PubChem CID 879496) has the molecular formula C19H21ClN2O2 and a molecular weight of 344.84 g/mol. Its IUPAC name is 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide
PubChem CID879496
Molecular FormulaC19H21ClN2O2
Molecular Weight344.84 g/mol
Exact Mass344.13
IUPAC Name3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide
SMILESCC(C)CNC(=O)c1cccc(NC(=O)Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C19H21ClN2O2/c1-13(2)12-21-19(24)15-4-3-5-17(11-15)22-18(23)10-14-6-8-16(20)9-7-14/h3-9,11,13H,10,12H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyZXUCCWOMAAIKGD-UHFFFAOYSA-N
XLogP3.91
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.84
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)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

3-[[2-(4-chlorophenyl)acetyl]amino]-N-ethylbenzamide
CID 17230707
3-[[2-(4-chlorophenyl)acetyl]amino]-N-propan-2-ylbenzamide
CID 17197433
3-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-N-(2-methylpropyl)benzamide
CID 2194290
3-[3-(3,4-difluorophenyl)propanoylamino]-N-(2-methylpropyl)benzamide
CID 131929456
3-[[2-(4-chlorophenyl)acetyl]amino]-N-(3-methylphenyl)benzamide
CID 1234677
3-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 43877795
3-[[2-(4-chlorophenyl)acetyl]amino]-N,N-dimethylbenzamide
CID 17231829
3-[(4-chlorophenyl)methoxy]-N-(2-methylpropyl)benzamide
CID 13176390
5-bromo-N-[3-(2-methylpropylcarbamoyl)phenyl]furan-2-carboxamide
CID 9323689
3-N-(3-acetamidophenyl)-1-N-(2-methylpropyl)benzene-1,3-dicarboxamide
CID 109051379
N-benzyl-3-[[2-(4-chlorophenyl)acetyl]amino]-N-methylbenzamide
CID 26162876
3-(cyclopropanecarbonylamino)-N-(2-methylpropyl)benzamide
CID 40603945

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide?
The IUPAC name of 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide (CID 879496) is 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide?
The canonical SMILES for 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide is CC(C)CNC(=O)c1cccc(NC(=O)Cc2ccc(Cl)cc2)c1.
What is the InChIKey of 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide?
The InChIKey is ZXUCCWOMAAIKGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O2/c1-13(2)12-21-19(24)15-4-3-5-17(11-15)22-18(23)10-14-6-8-16(20)9-7-14/h3-9,11,13H,10,12H2,1-2H3,(H,21,24)(H,22,23).
What are the key properties of 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide?
3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide has a molecular weight of 344.84 g/mol, XLogP of 3.91, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(4-chlorophenyl)acetyl]amino]-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 879496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).