2-phenyl-4-(trifluoromethoxy)benzamide

C14H10F3NO2 — CID 69076056

IUPAC2-phenyl-4-(trifluoromethoxy)benzamide
SMILESNC(=O)c1ccc(OC(F)(F)F)cc1-c1ccccc1
InChIInChI=1S/C14H10F3NO2/c15-14(16,17)20-10-6-7-11(13(18)19)12(8-10)9-4-2-1-3-5-9/h1-8H,(H2,18,19)
InChIKeyGCACOGHVSHSOII-UHFFFAOYSA-N
MW281.23 g/mol
LogP3.35
Rot. Bonds3

About 2-phenyl-4-(trifluoromethoxy)benzamide

2-phenyl-4-(trifluoromethoxy)benzamide (PubChem CID 69076056) has the molecular formula C14H10F3NO2 and a molecular weight of 281.23 g/mol. Its IUPAC name is 2-phenyl-4-(trifluoromethoxy)benzamide.

Molecular Properties

Compound Name2-phenyl-4-(trifluoromethoxy)benzamide
PubChem CID69076056
Molecular FormulaC14H10F3NO2
Molecular Weight281.23 g/mol
Exact Mass281.07
IUPAC Name2-phenyl-4-(trifluoromethoxy)benzamide
SMILESNC(=O)c1ccc(OC(F)(F)F)cc1-c1ccccc1
InChIInChI=1S/C14H10F3NO2/c15-14(16,17)20-10-6-7-11(13(18)19)12(8-10)9-4-2-1-3-5-9/h1-8H,(H2,18,19)
InChIKeyGCACOGHVSHSOII-UHFFFAOYSA-N
XLogP3.35
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.23
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-(trifluoromethoxy)benzamide?
The IUPAC name of 2-phenyl-4-(trifluoromethoxy)benzamide (CID 69076056) is 2-phenyl-4-(trifluoromethoxy)benzamide.
What is the SMILES notation for 2-phenyl-4-(trifluoromethoxy)benzamide?
The canonical SMILES for 2-phenyl-4-(trifluoromethoxy)benzamide is NC(=O)c1ccc(OC(F)(F)F)cc1-c1ccccc1.
What is the InChIKey of 2-phenyl-4-(trifluoromethoxy)benzamide?
The InChIKey is GCACOGHVSHSOII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3NO2/c15-14(16,17)20-10-6-7-11(13(18)19)12(8-10)9-4-2-1-3-5-9/h1-8H,(H2,18,19).
What are the key properties of 2-phenyl-4-(trifluoromethoxy)benzamide?
2-phenyl-4-(trifluoromethoxy)benzamide has a molecular weight of 281.23 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-(trifluoromethoxy)benzamide is sourced from PubChem (CID 69076056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).