2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide

C14H9ClFNO2 — CID 94286978

IUPAC2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide
SMILESO=C(Nc1cccc(F)c1)C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C14H9ClFNO2/c15-10-6-4-9(5-7-10)13(18)14(19)17-12-3-1-2-11(16)8-12/h1-8H,(H,17,19)
InChIKeyMQVNADHGQBGEKA-UHFFFAOYSA-N
MW277.68 g/mol
LogP3.30
Rot. Bonds3

About 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide

2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide (PubChem CID 94286978) has the molecular formula C14H9ClFNO2 and a molecular weight of 277.68 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide
PubChem CID94286978
Molecular FormulaC14H9ClFNO2
Molecular Weight277.68 g/mol
Exact Mass277.03
IUPAC Name2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide
SMILESO=C(Nc1cccc(F)c1)C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C14H9ClFNO2/c15-10-6-4-9(5-7-10)13(18)14(19)17-12-3-1-2-11(16)8-12/h1-8H,(H,17,19)
InChIKeyMQVNADHGQBGEKA-UHFFFAOYSA-N
XLogP3.30
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.68
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(4-chlorophenyl)methyl]-N'-(3-fluorophenyl)oxamide
CID 2272581
N-[2-(4-chlorophenyl)ethyl]-N'-(3-fluorophenyl)oxamide
CID 7292818
N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide
CID 108511843
N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide
CID 108522116
(Z)-2-amino-3-aminosulfanyl-3-(4-chlorophenyl)sulfanyl-N-(3-fluorophenyl)prop-2-enamide
CID 166887253
1-(3-chloro-4-fluorophenyl)-3-(3-fluorophenyl)urea
CID 108893983
4-chloro-N-[2-(3-fluoroanilino)-2-oxoethyl]-N-methylbenzamide
CID 7719433
3-bromo-4-fluoro-N-(3-fluorophenyl)benzamide
CID 103706269
N'-(4-amino-3-chlorophenyl)-N-(3-fluorophenyl)oxamide
CID 108516241
N'-(3-bromophenyl)-N-(3-fluorophenyl)oxamide
CID 108529598
4-chloro-N-[(2R)-1-(3-fluoroanilino)-4-methyl-1-oxopentan-2-yl]benzamide
CID 9412555
2-(4-chloroanilino)-N-(3-fluorophenyl)pyrimidine-5-carboxamide
CID 109268903

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide (CID 94286978) is 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide is O=C(Nc1cccc(F)c1)C(=O)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide?
The InChIKey is MQVNADHGQBGEKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClFNO2/c15-10-6-4-9(5-7-10)13(18)14(19)17-12-3-1-2-11(16)8-12/h1-8H,(H,17,19).
What are the key properties of 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide?
2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide has a molecular weight of 277.68 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide is sourced from PubChem (CID 94286978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).