N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide

C14H7ClF5NO — CID 17173190

IUPACN-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide
SMILESO=C(Nc1cc(C(F)(F)F)ccc1Cl)c1c(F)cccc1F
InChIInChI=1S/C14H7ClF5NO/c15-8-5-4-7(14(18,19)20)6-11(8)21-13(22)12-9(16)2-1-3-10(12)17/h1-6H,(H,21,22)
InChIKeyOYGVIYRKMYNXNV-UHFFFAOYSA-N
MW335.66 g/mol
LogP4.89
Rot. Bonds2

About N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide

N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide (PubChem CID 17173190) has the molecular formula C14H7ClF5NO and a molecular weight of 335.66 g/mol. Its IUPAC name is N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide.

Molecular Properties

Compound NameN-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide
PubChem CID17173190
Molecular FormulaC14H7ClF5NO
Molecular Weight335.66 g/mol
Exact Mass335.01
IUPAC NameN-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide
SMILESO=C(Nc1cc(C(F)(F)F)ccc1Cl)c1c(F)cccc1F
InChIInChI=1S/C14H7ClF5NO/c15-8-5-4-7(14(18,19)20)6-11(8)21-13(22)12-9(16)2-1-3-10(12)17/h1-6H,(H,21,22)
InChIKeyOYGVIYRKMYNXNV-UHFFFAOYSA-N
XLogP4.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.66
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-chloro-5-(trifluoromethyl)phenyl]-2-fluoro-6-[[3-(trifluoromethyl)benzoyl]amino]benzamide
CID 2801245
N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide
CID 78778889
N-(5-amino-2-chlorophenyl)-2,6-difluorobenzamide
CID 43548813
[(1R)-2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2,6-difluorobenzoate
CID 2367295
1-[2-chloro-5-(trifluoromethyl)phenyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 4173499
methyl 4-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl]benzoate
CID 54787072
1-[2-chloro-5-(trifluoromethyl)phenyl]-3-(2,4-difluorophenyl)urea
CID 17265299
N'-[2-chloro-5-(trifluoromethyl)phenyl]-N-[(2-fluorophenyl)methyl]oxamide
CID 108984915
N-(4-chlorophenyl)-N'-[2-chloro-5-(trifluoromethyl)phenyl]oxamide
CID 108987079
2-chloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-phenylacetamide
CID 4117637
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-methoxybenzamide
CID 871827
2-chloro-6-fluoro-N-[2-(trifluoromethyl)-4-[[3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]benzamide
CID 121264584

Frequently Asked Questions

What is the IUPAC name of N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide?
The IUPAC name of N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide (CID 17173190) is N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide.
What is the SMILES notation for N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide?
The canonical SMILES for N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide is O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1c(F)cccc1F.
What is the InChIKey of N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide?
The InChIKey is OYGVIYRKMYNXNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7ClF5NO/c15-8-5-4-7(14(18,19)20)6-11(8)21-13(22)12-9(16)2-1-3-10(12)17/h1-6H,(H,21,22).
What are the key properties of N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide?
N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide has a molecular weight of 335.66 g/mol, XLogP of 4.89, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-chloro-5-(trifluoromethyl)phenyl]-2,6-difluorobenzamide is sourced from PubChem (CID 17173190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).