2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide

C14H8ClF4NO — CID 775402

IUPAC2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(F)(F)F)c1c(F)cccc1Cl
InChIInChI=1S/C14H8ClF4NO/c15-9-5-3-6-10(16)12(9)13(21)20-11-7-2-1-4-8(11)14(17,18)19/h1-7H,(H,20,21)
InChIKeyXBRAABGFNOKQCS-UHFFFAOYSA-N
MW317.67 g/mol
LogP4.75
Rot. Bonds2

About 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide

2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide (PubChem CID 775402) has the molecular formula C14H8ClF4NO and a molecular weight of 317.67 g/mol. Its IUPAC name is 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide
PubChem CID775402
Molecular FormulaC14H8ClF4NO
Molecular Weight317.67 g/mol
Exact Mass317.02
IUPAC Name2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(F)(F)F)c1c(F)cccc1Cl
InChIInChI=1S/C14H8ClF4NO/c15-9-5-3-6-10(16)12(9)13(21)20-11-7-2-1-4-8(11)14(17,18)19/h1-7H,(H,20,21)
InChIKeyXBRAABGFNOKQCS-UHFFFAOYSA-N
XLogP4.75
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.67
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 37123
Benzamide, N-(4-chlorophenyl)-
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N-(3-Chlorophenyl)benzamide
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N-(2-Chlorophenyl)benzamide
CID 13918
2-Chloro-N-methyl-N-phenylbenzamide
CID 587357
4'-Bromo-2-chlorobenzanilide
CID 221829
3'-Chloro-M-toluanilide
CID 531963
N-(4-Fluorophenyl)benzamide
CID 242889
2-fluoro-N-(4-fluorophenyl)benzamide
CID 531933
N-(2-chlorophenyl)-4-methylbenzamide
CID 723111
N1-phenyl-3-(2-chlorophenyl)acrylamide
CID 737170
N-(4-chlorophenyl)-N'-(2,4-difluorobenzoyl)urea
CID 2823829

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide (CID 775402) is 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide is O=C(Nc1ccccc1C(F)(F)F)c1c(F)cccc1Cl.
What is the InChIKey of 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide?
The InChIKey is XBRAABGFNOKQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8ClF4NO/c15-9-5-3-6-10(16)12(9)13(21)20-11-7-2-1-4-8(11)14(17,18)19/h1-7H,(H,20,21).
What are the key properties of 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide?
2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide has a molecular weight of 317.67 g/mol, XLogP of 4.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-fluoro-N-[2-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 775402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).