4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide

C22H20ClN3O2 — CID 55976674

IUPAC4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide
SMILESNC(=O)Nc1ccc(C(=O)NC(Cc2ccc(Cl)cc2)c2ccccc2)cc1
InChIInChI=1S/C22H20ClN3O2/c23-18-10-6-15(7-11-18)14-20(16-4-2-1-3-5-16)26-21(27)17-8-12-19(13-9-17)25-22(24)28/h1-13,20H,14H2,(H,26,27)(H3,24,25,28)
InChIKeyKTBARFVHERSWKH-UHFFFAOYSA-N
MW393.87 g/mol
LogP4.54
Rot. Bonds6

About 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide

4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide (PubChem CID 55976674) has the molecular formula C22H20ClN3O2 and a molecular weight of 393.87 g/mol. Its IUPAC name is 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide
PubChem CID55976674
Molecular FormulaC22H20ClN3O2
Molecular Weight393.87 g/mol
Exact Mass393.12
IUPAC Name4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide
SMILESNC(=O)Nc1ccc(C(=O)NC(Cc2ccc(Cl)cc2)c2ccccc2)cc1
InChIInChI=1S/C22H20ClN3O2/c23-18-10-6-15(7-11-18)14-20(16-4-2-1-3-5-16)26-21(27)17-8-12-19(13-9-17)25-22(24)28/h1-13,20H,14H2,(H,26,27)(H3,24,25,28)
InChIKeyKTBARFVHERSWKH-UHFFFAOYSA-N
XLogP4.54
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.87
LogP ≤ 54.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]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-[4-(carbamoylamino)anilino]-3-oxo-1-phenylpropyl]benzamide
CID 55527938
4-chloro-N-[(1S)-2-hydroxy-1-phenylethyl]benzamide
CID 1480121
N-[[4-(carbamoylamino)phenyl]methyl]-4-chlorobenzamide
CID 52552945
4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 43887548
(4-chlorophenyl)methyl 3-benzamido-3-phenylpropanoate
CID 18277631
4-chloro-N-[(1R,3S)-3-hydroxy-1,3-diphenylpropyl]benzamide
CID 11024937
1,2-diphenylethylurea
CID 2853470
4-amino-N-[2-(4-chlorophenyl)-1-phenylethyl]butanamide
CID 119300535
4-chloro-N-[(1R)-2-(dimethylamino)-1-phenylethyl]benzamide
CID 8936052
N-[(1R)-1,2-diphenylethyl]-4-(imidazol-1-ylmethyl)benzamide
CID 95297781
N-[2-(4-chlorophenyl)-1-phenylethyl]-3-methylbutanamide
CID 60548268
N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide
CID 15658553

Frequently Asked Questions

What is the IUPAC name of 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide?
The IUPAC name of 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide (CID 55976674) is 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide.
What is the SMILES notation for 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide?
The canonical SMILES for 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide is NC(=O)Nc1ccc(C(=O)NC(Cc2ccc(Cl)cc2)c2ccccc2)cc1.
What is the InChIKey of 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide?
The InChIKey is KTBARFVHERSWKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20ClN3O2/c23-18-10-6-15(7-11-18)14-20(16-4-2-1-3-5-16)26-21(27)17-8-12-19(13-9-17)25-22(24)28/h1-13,20H,14H2,(H,26,27)(H3,24,25,28).
What are the key properties of 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide?
4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide has a molecular weight of 393.87 g/mol, XLogP of 4.54, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(carbamoylamino)-N-[2-(4-chlorophenyl)-1-phenylethyl]benzamide is sourced from PubChem (CID 55976674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).