2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide

C15H12ClNO2 — CID 13109495

IUPAC2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide
SMILESCN(C(=O)C(=O)c1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C15H12ClNO2/c1-17(13-5-3-2-4-6-13)15(19)14(18)11-7-9-12(16)10-8-11/h2-10H,1H3
InChIKeyNHVHAZSRGOXGGL-UHFFFAOYSA-N
MW273.72 g/mol
LogP3.19
Rot. Bonds3

About 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide

2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide (PubChem CID 13109495) has the molecular formula C15H12ClNO2 and a molecular weight of 273.72 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide
PubChem CID13109495
Molecular FormulaC15H12ClNO2
Molecular Weight273.72 g/mol
Exact Mass273.06
IUPAC Name2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide
SMILESCN(C(=O)C(=O)c1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C15H12ClNO2/c1-17(13-5-3-2-4-6-13)15(19)14(18)11-7-9-12(16)10-8-11/h2-10H,1H3
InChIKeyNHVHAZSRGOXGGL-UHFFFAOYSA-N
XLogP3.19
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.72
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

2-(4-chlorophenyl)-N,N-dimethyl-2-oxoacetamide
CID 82113368
1-[(Z)-1-(4-chlorophenyl)prop-1-enyl]-1,3-dimethyl-3-phenylurea
CID 102415940
N-(4-chlorophenyl)-N-methyl-3-oxo-3-phenylpropanamide
CID 4255555
2-(4-chlorophenyl)-N,N-diethyl-2-oxoacetamide
CID 11310994
3,5-dichloro-N-methyl-N-phenylbenzamide;ethane
CID 156791859
1-[(4-chlorophenyl)methyl]-1,3-dimethyl-3-phenylurea
CID 580681
N-(2-chlorophenyl)-2-(4-chlorophenyl)-N-hydroxy-2-oxoacetamide
CID 10380658
N-methyl-2-oxo-N-phenyl-2-thiophen-2-ylacetamide
CID 82118278
2-diazo-2-(3,4-dichlorophenyl)-N-methyl-N-phenylacetamide
CID 154710022
(E)-N,2-dimethyl-N-phenylbut-2-enamide
CID 10867125
[2-(N-methylanilino)-2-oxoethyl] 2-(4-chlorobenzoyl)benzoate
CID 2715062
4-chloro-N-nitroso-N-phenylbenzamide
CID 134880089

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide (CID 13109495) is 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide is CN(C(=O)C(=O)c1ccc(Cl)cc1)c1ccccc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide?
The InChIKey is NHVHAZSRGOXGGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClNO2/c1-17(13-5-3-2-4-6-13)15(19)14(18)11-7-9-12(16)10-8-11/h2-10H,1H3.
What are the key properties of 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide?
2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide has a molecular weight of 273.72 g/mol, XLogP of 3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide is sourced from PubChem (CID 13109495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).