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

C23H21ClN2O2 — CID 43887548

IUPAC4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
SMILESCC(NC(=O)c1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1)c1ccccc1
InChIInChI=1S/C23H21ClN2O2/c1-16(18-5-3-2-4-6-18)25-23(28)19-9-13-21(14-10-19)26-22(27)15-17-7-11-20(24)12-8-17/h2-14,16H,15H2,1H3,(H,25,28)(H,26,27)
InChIKeyURAWSHIVZGHUAR-UHFFFAOYSA-N
MW392.89 g/mol
LogP5.01
Rot. Bonds6

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

4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide (PubChem CID 43887548) has the molecular formula C23H21ClN2O2 and a molecular weight of 392.89 g/mol. Its IUPAC name is 4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide.

Molecular Properties

Compound Name4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
PubChem CID43887548
Molecular FormulaC23H21ClN2O2
Molecular Weight392.89 g/mol
Exact Mass392.13
IUPAC Name4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
SMILESCC(NC(=O)c1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1)c1ccccc1
InChIInChI=1S/C23H21ClN2O2/c1-16(18-5-3-2-4-6-18)25-23(28)19-9-13-21(14-10-19)26-22(27)15-17-7-11-20(24)12-8-17/h2-14,16H,15H2,1H3,(H,25,28)(H,26,27)
InChIKeyURAWSHIVZGHUAR-UHFFFAOYSA-N
XLogP5.01
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.89
LogP ≤ 55.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 43877795
4-[3-(2-chlorophenyl)propanoylamino]-N-(1-phenylethyl)benzamide
CID 43887660
4-benzamido-N-(1-phenylethyl)benzamide
CID 17153199
4-acetamido-N-(1-phenylethyl)benzamide
CID 2841785
4-[[2-(3,4-dichloroanilino)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 54813173
4-[[2-(4-fluoroanilino)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 54813381
N-(1-phenylethyl)-4-[[2-(prop-2-enylamino)acetyl]amino]benzamide
CID 54820620
2-(4-chlorophenyl)-N-[(1R)-1-(4-chlorophenyl)ethyl]acetamide
CID 8751569
3-[[2-(4-methoxyphenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 43877752
(2S)-4-(4-chloroanilino)-4-oxo-2-[[(1R)-1-phenylethyl]amino]butanoic acid
CID 7590961
ethyl N-[4-[[(1S)-1-phenylethyl]carbamoyl]phenyl]carbamate
CID 9033040
2-(4-chloroanilino)-N-[(1S)-1-phenylethyl]acetamide
CID 9098999

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide?
The IUPAC name of 4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide (CID 43887548) is 4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide.
What is the SMILES notation for 4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide?
The canonical SMILES for 4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide is CC(NC(=O)c1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1)c1ccccc1.
What is the InChIKey of 4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide?
The InChIKey is URAWSHIVZGHUAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClN2O2/c1-16(18-5-3-2-4-6-18)25-23(28)19-9-13-21(14-10-19)26-22(27)15-17-7-11-20(24)12-8-17/h2-14,16H,15H2,1H3,(H,25,28)(H,26,27).
What are the key properties of 4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide?
4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide has a molecular weight of 392.89 g/mol, XLogP of 5.01, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide is sourced from PubChem (CID 43887548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).