N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide

C21H17ClN2O2 — CID 15658553

IUPACN-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide
SMILESO=C(NC(C(=O)Nc1ccc(Cl)cc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H17ClN2O2/c22-17-11-13-18(14-12-17)23-21(26)19(15-7-3-1-4-8-15)24-20(25)16-9-5-2-6-10-16/h1-14,19H,(H,23,26)(H,24,25)
InChIKeyXELMPQAPJZYPEG-UHFFFAOYSA-N
MW364.83 g/mol
LogP4.45
Rot. Bonds5

About N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide

N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide (PubChem CID 15658553) has the molecular formula C21H17ClN2O2 and a molecular weight of 364.83 g/mol. Its IUPAC name is N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide.

Molecular Properties

Compound NameN-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide
PubChem CID15658553
Molecular FormulaC21H17ClN2O2
Molecular Weight364.83 g/mol
Exact Mass364.10
IUPAC NameN-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide
SMILESO=C(NC(C(=O)Nc1ccc(Cl)cc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C21H17ClN2O2/c22-17-11-13-18(14-12-17)23-21(26)19(15-7-3-1-4-8-15)24-20(25)16-9-5-2-6-10-16/h1-14,19H,(H,23,26)(H,24,25)
InChIKeyXELMPQAPJZYPEG-UHFFFAOYSA-N
XLogP4.45
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.83
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-N-[(1S)-2-[4-(hydroxyamino)anilino]-2-oxo-1-phenylethyl]benzamide
CID 72705119
2-[(4-chlorophenyl)carbamoylamino]-N-[4-(2,2-dimethylhydrazinyl)phenyl]-2-phenylacetamide
CID 90820759
3-bromo-N-[(1S)-2-[4-(hydroxycarbamoyl)anilino]-2-oxo-1-phenylethyl]benzamide
CID 171346842
N-(2-anilino-2-oxo-1-phenylethyl)-4-ethylbenzamide
CID 55726687
N-(4-chlorophenyl)benzamide;hydrochloride
CID 139912610
N-(2-hydrazinyl-2-oxo-1-phenylethyl)benzamide
CID 4534244
2-amino-N-(4-chlorophenyl)-2-phenylacetamide
CID 24702199
N-[2-[[amino(phenyl)methylidene]amino]-2-oxo-1-phenylethyl]-4-chlorobenzamide
CID 121264156
N-[2-(2,4-difluoroanilino)-2-oxo-1-phenylethyl]benzamide
CID 55455707
N-(2-anilino-2-oxo-1-phenylethyl)-4-(dimethylsulfamoyl)benzamide
CID 55779161
4-chloro-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 110286769
N-[4-[[(4-chlorobenzoyl)amino]carbamoyl]phenyl]benzamide
CID 1100705

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide?
The IUPAC name of N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide (CID 15658553) is N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide.
What is the SMILES notation for N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide?
The canonical SMILES for N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide is O=C(NC(C(=O)Nc1ccc(Cl)cc1)c1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide?
The InChIKey is XELMPQAPJZYPEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClN2O2/c22-17-11-13-18(14-12-17)23-21(26)19(15-7-3-1-4-8-15)24-20(25)16-9-5-2-6-10-16/h1-14,19H,(H,23,26)(H,24,25).
What are the key properties of N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide?
N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide has a molecular weight of 364.83 g/mol, XLogP of 4.45, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chloroanilino)-2-oxo-1-phenylethyl]benzamide is sourced from PubChem (CID 15658553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).