5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide

C15H10ClF4NO2 — CID 155520788

IUPAC5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide
SMILESO=C(NCc1ccc(C(F)(F)F)c(F)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C15H10ClF4NO2/c16-9-2-4-13(22)10(6-9)14(23)21-7-8-1-3-11(12(17)5-8)15(18,19)20/h1-6,22H,7H2,(H,21,23)
InChIKeyZPXDABFFJPVGLB-UHFFFAOYSA-N
MW347.70 g/mol
LogP4.13
Rot. Bonds3

About 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide

5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide (PubChem CID 155520788) has the molecular formula C15H10ClF4NO2 and a molecular weight of 347.70 g/mol. Its IUPAC name is 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide
PubChem CID155520788
Molecular FormulaC15H10ClF4NO2
Molecular Weight347.70 g/mol
Exact Mass347.03
IUPAC Name5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide
SMILESO=C(NCc1ccc(C(F)(F)F)c(F)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C15H10ClF4NO2/c16-9-2-4-13(22)10(6-9)14(23)21-7-8-1-3-11(12(17)5-8)15(18,19)20/h1-6,22H,7H2,(H,21,23)
InChIKeyZPXDABFFJPVGLB-UHFFFAOYSA-N
XLogP4.13
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.70
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide (CID 155520788) is 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide is O=C(NCc1ccc(C(F)(F)F)c(F)c1)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide?
The InChIKey is ZPXDABFFJPVGLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClF4NO2/c16-9-2-4-13(22)10(6-9)14(23)21-7-8-1-3-11(12(17)5-8)15(18,19)20/h1-6,22H,7H2,(H,21,23).
What are the key properties of 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide?
5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide has a molecular weight of 347.70 g/mol, XLogP of 4.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]-2-hydroxybenzamide is sourced from PubChem (CID 155520788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).