4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide

C21H16ClNO2 — CID 732485

IUPAC4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(Cl)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H16ClNO2/c22-19-12-10-18(11-13-19)21(25)23-14-20(24)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-13H,14H2,(H,23,25)
InChIKeyHKLSQOGOFOPFCR-UHFFFAOYSA-N
MW349.82 g/mol
LogP4.62
Rot. Bonds5

About 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide

4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide (PubChem CID 732485) has the molecular formula C21H16ClNO2 and a molecular weight of 349.82 g/mol. Its IUPAC name is 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide
PubChem CID732485
Molecular FormulaC21H16ClNO2
Molecular Weight349.82 g/mol
Exact Mass349.09
IUPAC Name4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(Cl)cc1)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C21H16ClNO2/c22-19-12-10-18(11-13-19)21(25)23-14-20(24)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-13H,14H2,(H,23,25)
InChIKeyHKLSQOGOFOPFCR-UHFFFAOYSA-N
XLogP4.62
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.82
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-(phenacylcarbamothioyl)benzamide
CID 2294592
4-chloro-N-[2-oxo-2-[(2E)-2-[2-phenyl-1-(4-phenylphenyl)ethylidene]hydrazinyl]ethyl]benzamide
CID 16761074
N-[2-(2-benzoylhydrazinyl)-2-oxoethyl]-4-chlorobenzamide
CID 9414874
2-[(4-chlorobenzoyl)amino]acetyl chloride
CID 14545092
N-[2-oxo-2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 155676275
4-chloro-N-(2-oxo-2-thiophen-2-ylethyl)benzamide
CID 13105423
5-chloro-N-phenacylpyridine-2-carboxamide
CID 64991922
2,4-dichloro-N-[2-[(4-phenylbenzoyl)amino]ethyl]benzamide
CID 108570885
N-[[1-(4-chlorophenyl)tetrazol-5-yl]methyl]-4-phenylbenzamide
CID 16799246
4-chloro-N-[2-[(4-oxo-4-phenylbutanoyl)amino]ethyl]benzamide
CID 134039930
N-[2-(ethoxyamino)-2-oxoethyl]-4-phenylbenzamide
CID 18169121
3-chloro-4-methyl-N-phenacylbenzamide
CID 64991400

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide?
The IUPAC name of 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide (CID 732485) is 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide.
What is the SMILES notation for 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide?
The canonical SMILES for 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide is O=C(CNC(=O)c1ccc(Cl)cc1)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide?
The InChIKey is HKLSQOGOFOPFCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16ClNO2/c22-19-12-10-18(11-13-19)21(25)23-14-20(24)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-13H,14H2,(H,23,25).
What are the key properties of 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide?
4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide has a molecular weight of 349.82 g/mol, XLogP of 4.62, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-oxo-2-(4-phenylphenyl)ethyl]benzamide is sourced from PubChem (CID 732485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).