2,3-difluoro-6-(trifluoromethyl)benzamide

C8H4F5NO — CID 22010119

IUPAC2,3-difluoro-6-(trifluoromethyl)benzamide
SMILESNC(=O)c1c(C(F)(F)F)ccc(F)c1F
InChIInChI=1S/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)
InChIKeyGGCPJJFCTISPMQ-UHFFFAOYSA-N
MW225.12 g/mol
LogP2.08
Rot. Bonds1

About 2,3-difluoro-6-(trifluoromethyl)benzamide

2,3-difluoro-6-(trifluoromethyl)benzamide (PubChem CID 22010119) has the molecular formula C8H4F5NO and a molecular weight of 225.12 g/mol. Its IUPAC name is 2,3-difluoro-6-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name2,3-difluoro-6-(trifluoromethyl)benzamide
PubChem CID22010119
Molecular FormulaC8H4F5NO
Molecular Weight225.12 g/mol
Exact Mass225.02
IUPAC Name2,3-difluoro-6-(trifluoromethyl)benzamide
SMILESNC(=O)c1c(C(F)(F)F)ccc(F)c1F
InChIInChI=1S/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15)
InChIKeyGGCPJJFCTISPMQ-UHFFFAOYSA-N
XLogP2.08
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.12
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-6-(trifluoromethyl)benzamide?
The IUPAC name of 2,3-difluoro-6-(trifluoromethyl)benzamide (CID 22010119) is 2,3-difluoro-6-(trifluoromethyl)benzamide.
What is the SMILES notation for 2,3-difluoro-6-(trifluoromethyl)benzamide?
The canonical SMILES for 2,3-difluoro-6-(trifluoromethyl)benzamide is NC(=O)c1c(C(F)(F)F)ccc(F)c1F.
What is the InChIKey of 2,3-difluoro-6-(trifluoromethyl)benzamide?
The InChIKey is GGCPJJFCTISPMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4F5NO/c9-4-2-1-3(8(11,12)13)5(6(4)10)7(14)15/h1-2H,(H2,14,15).
What are the key properties of 2,3-difluoro-6-(trifluoromethyl)benzamide?
2,3-difluoro-6-(trifluoromethyl)benzamide has a molecular weight of 225.12 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-6-(trifluoromethyl)benzamide is sourced from PubChem (CID 22010119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).