N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide

C16H14F2N2O3 — CID 44998456

IUPACN-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
SMILESCOc1ccc(C)cc1NC(=O)C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C16H14F2N2O3/c1-9-3-6-14(23-2)13(7-9)20-16(22)15(21)19-12-5-4-10(17)8-11(12)18/h3-8H,1-2H3,(H,19,21)(H,20,22)
InChIKeyXDJBAJJGIOXYEP-UHFFFAOYSA-N
MW320.30 g/mol
LogP2.86
Rot. Bonds3

About N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide

N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide (PubChem CID 44998456) has the molecular formula C16H14F2N2O3 and a molecular weight of 320.30 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
PubChem CID44998456
Molecular FormulaC16H14F2N2O3
Molecular Weight320.30 g/mol
Exact Mass320.10
IUPAC NameN-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
SMILESCOc1ccc(C)cc1NC(=O)C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C16H14F2N2O3/c1-9-3-6-14(23-2)13(7-9)20-16(22)15(21)19-12-5-4-10(17)8-11(12)18/h3-8H,1-2H3,(H,19,21)(H,20,22)
InChIKeyXDJBAJJGIOXYEP-UHFFFAOYSA-N
XLogP2.86
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.30
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)propanediamide
CID 108955812
N'-(5-chloro-2-methoxyphenyl)-N-(2,4-difluorophenyl)oxamide
CID 108502324
N'-(2-methoxy-5-methylphenyl)-N-(2,3,4-trifluorophenyl)oxamide
CID 108515639
N'-(2,4-difluorophenyl)-N-(2,4-dimethylphenyl)oxamide
CID 44998488
N'-(2,4-difluorophenyl)-N-(2,4-dimethoxyphenyl)oxamide
CID 44998467
N-(2,4-difluorophenyl)-6-(2-methoxy-5-methylanilino)pyrimidine-4-carboxamide
CID 109359110
2-(2,4-difluoroanilino)-N-(2-methoxy-5-methylphenyl)pyrimidine-4-carboxamide
CID 109317953
N-(4-bromo-2-methylphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
CID 108515633
N-(4-amino-2-methylphenyl)-N'-(2-methoxy-5-methylphenyl)oxamide
CID 155119428
N-(2,4-difluorophenyl)-2-[1-(2-methoxy-5-methylphenyl)ethylamino]propanamide
CID 51244088
N-(2-bromo-4-methylphenyl)-N'-(2,5-dimethoxyphenyl)oxamide
CID 108511999
2-(6-fluoro-1H-indol-3-yl)-N-(2-methoxy-5-methylphenyl)-2-oxoacetamide
CID 113208672

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide?
The IUPAC name of N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide (CID 44998456) is N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide is COc1ccc(C)cc1NC(=O)C(=O)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide?
The InChIKey is XDJBAJJGIOXYEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2N2O3/c1-9-3-6-14(23-2)13(7-9)20-16(22)15(21)19-12-5-4-10(17)8-11(12)18/h3-8H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide?
N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide has a molecular weight of 320.30 g/mol, XLogP of 2.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-N'-(2-methoxy-5-methylphenyl)oxamide is sourced from PubChem (CID 44998456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).