N-(2,4-difluorophenyl)-2-oxoacetamide

C8H5F2NO2 — CID 115165918

IUPACN-(2,4-difluorophenyl)-2-oxoacetamide
SMILESO=CC(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C8H5F2NO2/c9-5-1-2-7(6(10)3-5)11-8(13)4-12/h1-4H,(H,11,13)
InChIKeyMNZNYIQXGSYGSB-UHFFFAOYSA-N
MW185.13 g/mol
LogP1.10
Rot. Bonds2

About N-(2,4-difluorophenyl)-2-oxoacetamide

N-(2,4-difluorophenyl)-2-oxoacetamide (PubChem CID 115165918) has the molecular formula C8H5F2NO2 and a molecular weight of 185.13 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-oxoacetamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-oxoacetamide
PubChem CID115165918
Molecular FormulaC8H5F2NO2
Molecular Weight185.13 g/mol
Exact Mass185.03
IUPAC NameN-(2,4-difluorophenyl)-2-oxoacetamide
SMILESO=CC(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C8H5F2NO2/c9-5-1-2-7(6(10)3-5)11-8(13)4-12/h1-4H,(H,11,13)
InChIKeyMNZNYIQXGSYGSB-UHFFFAOYSA-N
XLogP1.10
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.13
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2,4-difluorophenyl)prop-2-enamide
CID 23202681
N-(4-bromo-2-fluorophenyl)-2-oxoacetamide
CID 146561302
1-N,4-N-bis(2,4-difluorophenyl)benzene-1,4-dicarboxamide
CID 3596826
2-(2,4-difluoroanilino)-N-(2,4-difluorophenyl)acetamide
CID 109011050
N-(2,4-difluorophenyl)hexanamide
CID 3484261
1-N,2-N-bis(2,4-difluorophenyl)benzene-1,2-dicarboxamide
CID 4062467
(E)-4-[(2,4-difluorophenyl)carbamoylamino]-4-oxobut-2-enoic acid
CID 28746433
1-(2,4-difluorophenyl)-3-(4-fluoro-2-methylphenyl)urea
CID 17263659
1-(2,4-difluorophenyl)-3-(2,3,4-trifluorophenyl)urea
CID 108892630
N-(2,4-difluorophenyl)-2,6-difluorobenzamide
CID 2796874
1-N,2-N-bis(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144111
1-(2,4-difluorophenyl)-3-(3,5-difluorophenyl)urea
CID 46859669

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-oxoacetamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-oxoacetamide (CID 115165918) is N-(2,4-difluorophenyl)-2-oxoacetamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-oxoacetamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-oxoacetamide is O=CC(=O)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-2-oxoacetamide?
The InChIKey is MNZNYIQXGSYGSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5F2NO2/c9-5-1-2-7(6(10)3-5)11-8(13)4-12/h1-4H,(H,11,13).
What are the key properties of N-(2,4-difluorophenyl)-2-oxoacetamide?
N-(2,4-difluorophenyl)-2-oxoacetamide has a molecular weight of 185.13 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-oxoacetamide is sourced from PubChem (CID 115165918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).