N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide

C14H8F5NO — CID 7958863

IUPACN-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide
SMILESO=C(Nc1cc(F)ccc1F)c1ccccc1C(F)(F)F
InChIInChI=1S/C14H8F5NO/c15-8-5-6-11(16)12(7-8)20-13(21)9-3-1-2-4-10(9)14(17,18)19/h1-7H,(H,20,21)
InChIKeyKVTDNTGGVYJKKQ-UHFFFAOYSA-N
MW301.21 g/mol
LogP4.24
Rot. Bonds2

About N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide

N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide (PubChem CID 7958863) has the molecular formula C14H8F5NO and a molecular weight of 301.21 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide
PubChem CID7958863
Molecular FormulaC14H8F5NO
Molecular Weight301.21 g/mol
Exact Mass301.05
IUPAC NameN-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide
SMILESO=C(Nc1cc(F)ccc1F)c1ccccc1C(F)(F)F
InChIInChI=1S/C14H8F5NO/c15-8-5-6-11(16)12(7-8)20-13(21)9-3-1-2-4-10(9)14(17,18)19/h1-7H,(H,20,21)
InChIKeyKVTDNTGGVYJKKQ-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 N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide?
The IUPAC name of N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide (CID 7958863) is N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide?
The canonical SMILES for N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide is O=C(Nc1cc(F)ccc1F)c1ccccc1C(F)(F)F.
What is the InChIKey of N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide?
The InChIKey is KVTDNTGGVYJKKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F5NO/c15-8-5-6-11(16)12(7-8)20-13(21)9-3-1-2-4-10(9)14(17,18)19/h1-7H,(H,20,21).
What are the key properties of N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide?
N-(2,5-difluorophenyl)-2-(trifluoromethyl)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 N-(2,5-difluorophenyl)-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 7958863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).