N'-(2,6-difluorophenyl)-N-methyloxamide

C9H8F2N2O2 — CID 47224850

IUPACN'-(2,6-difluorophenyl)-N-methyloxamide
SMILESCNC(=O)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C9H8F2N2O2/c1-12-8(14)9(15)13-7-5(10)3-2-4-6(7)11/h2-4H,1H3,(H,12,14)(H,13,15)
InChIKeyAFJYWYGNEMBDFM-UHFFFAOYSA-N
MW214.17 g/mol
LogP0.65
Rot. Bonds1

About N'-(2,6-difluorophenyl)-N-methyloxamide

N'-(2,6-difluorophenyl)-N-methyloxamide (PubChem CID 47224850) has the molecular formula C9H8F2N2O2 and a molecular weight of 214.17 g/mol. Its IUPAC name is N'-(2,6-difluorophenyl)-N-methyloxamide.

Molecular Properties

Compound NameN'-(2,6-difluorophenyl)-N-methyloxamide
PubChem CID47224850
Molecular FormulaC9H8F2N2O2
Molecular Weight214.17 g/mol
Exact Mass214.06
IUPAC NameN'-(2,6-difluorophenyl)-N-methyloxamide
SMILESCNC(=O)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C9H8F2N2O2/c1-12-8(14)9(15)13-7-5(10)3-2-4-6(7)11/h2-4H,1H3,(H,12,14)(H,13,15)
InChIKeyAFJYWYGNEMBDFM-UHFFFAOYSA-N
XLogP0.65
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.17
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N'-(2,6-difluorophenyl)-N-methyloxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,6-difluorophenyl)-N'-methoxyoxamide
CID 99636399
N'-(2,6-difluorophenyl)-N-(2,4,6-trimethylphenyl)oxamide
CID 108512223
N'-(2,6-difluorophenyl)-N-(3-methylphenyl)oxamide
CID 108515662
N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide
CID 108522116
N-(2-chlorophenyl)-N'-(2,6-difluorophenyl)oxamide
CID 108500285
(E)-4-(2,6-difluoroanilino)-3-methyl-4-oxobut-2-enoic acid
CID 82335518
N-(3-bromophenyl)-N'-(2,6-difluorophenyl)oxamide
CID 108522076
N'-(2,6-difluorophenyl)-N-(3-methoxypropyl)oxamide
CID 47224631
N-(3-chloropropyl)-N'-(2,6-difluorophenyl)oxamide
CID 108513680
1-(2,6-difluorophenyl)-3-(2,6-dimethylphenyl)urea
CID 108991420
2-bromo-N-(2,6-difluorophenyl)-2-methylpropanamide
CID 82110411
1-(2-chloro-6-fluorophenyl)-3-methylurea
CID 21161279

Frequently Asked Questions

What is the IUPAC name of N'-(2,6-difluorophenyl)-N-methyloxamide?
The IUPAC name of N'-(2,6-difluorophenyl)-N-methyloxamide (CID 47224850) is N'-(2,6-difluorophenyl)-N-methyloxamide.
What is the SMILES notation for N'-(2,6-difluorophenyl)-N-methyloxamide?
The canonical SMILES for N'-(2,6-difluorophenyl)-N-methyloxamide is CNC(=O)C(=O)Nc1c(F)cccc1F.
What is the InChIKey of N'-(2,6-difluorophenyl)-N-methyloxamide?
The InChIKey is AFJYWYGNEMBDFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F2N2O2/c1-12-8(14)9(15)13-7-5(10)3-2-4-6(7)11/h2-4H,1H3,(H,12,14)(H,13,15).
What are the key properties of N'-(2,6-difluorophenyl)-N-methyloxamide?
N'-(2,6-difluorophenyl)-N-methyloxamide has a molecular weight of 214.17 g/mol, XLogP of 0.65, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,6-difluorophenyl)-N-methyloxamide is sourced from PubChem (CID 47224850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).