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

C9H8F2N2O3 — CID 99636399

IUPACN-(2,6-difluorophenyl)-N'-methoxyoxamide
SMILESCONC(=O)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C9H8F2N2O3/c1-16-13-9(15)8(14)12-7-5(10)3-2-4-6(7)11/h2-4H,1H3,(H,12,14)(H,13,15)
InChIKeyBIOBCKZIHDDGHN-UHFFFAOYSA-N
MW230.17 g/mol
LogP0.58
Rot. Bonds2

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

N-(2,6-difluorophenyl)-N'-methoxyoxamide (PubChem CID 99636399) has the molecular formula C9H8F2N2O3 and a molecular weight of 230.17 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-N'-methoxyoxamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-N'-methoxyoxamide
PubChem CID99636399
Molecular FormulaC9H8F2N2O3
Molecular Weight230.17 g/mol
Exact Mass230.05
IUPAC NameN-(2,6-difluorophenyl)-N'-methoxyoxamide
SMILESCONC(=O)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C9H8F2N2O3/c1-16-13-9(15)8(14)12-7-5(10)3-2-4-6(7)11/h2-4H,1H3,(H,12,14)(H,13,15)
InChIKeyBIOBCKZIHDDGHN-UHFFFAOYSA-N
XLogP0.58
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.17
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(2,6-difluorophenyl)-N-methyloxamide
CID 47224850
N'-(2,6-difluorophenyl)-N-(2,4,6-trimethylphenyl)oxamide
CID 108512223
N'-(2,6-difluorophenyl)-N-(3-methoxypropyl)oxamide
CID 47224631
N-(5-chloro-2-methoxyphenyl)-N'-(2,6-difluorophenyl)oxamide
CID 108502213
N'-(2,6-difluorophenyl)-N-(3-methylphenyl)oxamide
CID 108515662
methyl 2-(2-bromo-6-fluoroanilino)-2-oxoacetate
CID 107602508
1-(2,6-difluorophenyl)-3-(2,6-dimethoxyphenyl)urea
CID 108867921
N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide
CID 108522116
2-amino-N-(2,6-difluorophenyl)propanamide
CID 43087644
N-(5-bromo-2-fluorophenyl)-N'-methoxyoxamide
CID 99636400
N-(2-chlorophenyl)-N'-(2,6-difluorophenyl)oxamide
CID 108500285
(E)-4-(2,6-difluoroanilino)-3-methyl-4-oxobut-2-enoic acid
CID 82335518

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-N'-methoxyoxamide?
The IUPAC name of N-(2,6-difluorophenyl)-N'-methoxyoxamide (CID 99636399) is N-(2,6-difluorophenyl)-N'-methoxyoxamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-N'-methoxyoxamide?
The canonical SMILES for N-(2,6-difluorophenyl)-N'-methoxyoxamide is CONC(=O)C(=O)Nc1c(F)cccc1F.
What is the InChIKey of N-(2,6-difluorophenyl)-N'-methoxyoxamide?
The InChIKey is BIOBCKZIHDDGHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F2N2O3/c1-16-13-9(15)8(14)12-7-5(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'-methoxyoxamide?
N-(2,6-difluorophenyl)-N'-methoxyoxamide has a molecular weight of 230.17 g/mol, XLogP of 0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-N'-methoxyoxamide is sourced from PubChem (CID 99636399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).