N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide

C14H9F3N2O2 — CID 108522116

IUPACN'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide
SMILESO=C(Nc1cccc(F)c1)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C14H9F3N2O2/c15-8-3-1-4-9(7-8)18-13(20)14(21)19-12-10(16)5-2-6-11(12)17/h1-7H,(H,18,20)(H,19,21)
InChIKeyNANCAAZSCWKJGJ-UHFFFAOYSA-N
MW294.23 g/mol
LogP2.68
Rot. Bonds2

About N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide

N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide (PubChem CID 108522116) has the molecular formula C14H9F3N2O2 and a molecular weight of 294.23 g/mol. Its IUPAC name is N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide.

Molecular Properties

Compound NameN'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide
PubChem CID108522116
Molecular FormulaC14H9F3N2O2
Molecular Weight294.23 g/mol
Exact Mass294.06
IUPAC NameN'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide
SMILESO=C(Nc1cccc(F)c1)C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C14H9F3N2O2/c15-8-3-1-4-9(7-8)18-13(20)14(21)19-12-10(16)5-2-6-11(12)17/h1-7H,(H,18,20)(H,19,21)
InChIKeyNANCAAZSCWKJGJ-UHFFFAOYSA-N
XLogP2.68
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.23
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-bromophenyl)-N'-(2,6-difluorophenyl)oxamide
CID 108522076
N'-(2,6-difluorophenyl)-N-(3-methylphenyl)oxamide
CID 108515662
N'-(2,6-dimethylphenyl)-N-(3-fluorophenyl)oxamide
CID 108531930
N'-(2,6-difluorophenyl)-N-[3-(trifluoromethyl)phenyl]oxamide
CID 108501381
N'-(3-bromophenyl)-N-(3-fluorophenyl)oxamide
CID 108529598
N'-(2,6-difluorophenyl)-N-methyloxamide
CID 47224850
2-(4-chlorophenyl)-N-(3-fluorophenyl)-2-oxoacetamide
CID 94286978
N'-(3-fluorophenyl)-N-(3-nitrophenyl)oxamide
CID 108513374
N-(3-fluorophenyl)carbamoyl iodide
CID 143189904
(3-fluorophenyl)carbamic acid;hydrochloride
CID 70589934
N-[(4-chlorophenyl)methyl]-N'-(3-fluorophenyl)oxamide
CID 2272581
N'-(5-chloro-2-methylphenyl)-N-(3-fluorophenyl)oxamide
CID 108511843

Frequently Asked Questions

What is the IUPAC name of N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide?
The IUPAC name of N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide (CID 108522116) is N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide.
What is the SMILES notation for N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide?
The canonical SMILES for N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide is O=C(Nc1cccc(F)c1)C(=O)Nc1c(F)cccc1F.
What is the InChIKey of N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide?
The InChIKey is NANCAAZSCWKJGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F3N2O2/c15-8-3-1-4-9(7-8)18-13(20)14(21)19-12-10(16)5-2-6-11(12)17/h1-7H,(H,18,20)(H,19,21).
What are the key properties of N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide?
N'-(2,6-difluorophenyl)-N-(3-fluorophenyl)oxamide has a molecular weight of 294.23 g/mol, XLogP of 2.68, 2 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-(3-fluorophenyl)oxamide is sourced from PubChem (CID 108522116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).