2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide

C14H8F5NO — CID 8896585

IUPAC2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(F)(F)F)c1ccc(F)cc1F
InChIInChI=1S/C14H8F5NO/c15-8-5-6-9(11(16)7-8)13(21)20-12-4-2-1-3-10(12)14(17,18)19/h1-7H,(H,20,21)
InChIKeyWRMDXSUWBDODMX-UHFFFAOYSA-N
MW301.21 g/mol
LogP4.24
Rot. Bonds2

About 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide

2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide (PubChem CID 8896585) has the molecular formula C14H8F5NO and a molecular weight of 301.21 g/mol. Its IUPAC name is 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide
PubChem CID8896585
Molecular FormulaC14H8F5NO
Molecular Weight301.21 g/mol
Exact Mass301.05
IUPAC Name2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(F)(F)F)c1ccc(F)cc1F
InChIInChI=1S/C14H8F5NO/c15-8-5-6-9(11(16)7-8)13(21)20-12-4-2-1-3-10(12)14(17,18)19/h1-7H,(H,20,21)
InChIKeyWRMDXSUWBDODMX-UHFFFAOYSA-N
XLogP4.24
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.21
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide (CID 8896585) is 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide is O=C(Nc1ccccc1C(F)(F)F)c1ccc(F)cc1F.
What is the InChIKey of 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide?
The InChIKey is WRMDXSUWBDODMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F5NO/c15-8-5-6-9(11(16)7-8)13(21)20-12-4-2-1-3-10(12)14(17,18)19/h1-7H,(H,20,21).
What are the key properties of 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide?
2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide has a molecular weight of 301.21 g/mol, XLogP of 4.24, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-[2-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 8896585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).