5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide

C14H9ClF3NO2 — CID 23073720

IUPAC5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide
SMILESNC(=O)c1cc(Cl)cc(-c2ccc(C(F)(F)F)cc2)c1O
InChIInChI=1S/C14H9ClF3NO2/c15-9-5-10(12(20)11(6-9)13(19)21)7-1-3-8(4-2-7)14(16,17)18/h1-6,20H,(H2,19,21)
InChIKeyODDZYRABWRIPLF-UHFFFAOYSA-N
MW315.68 g/mol
LogP3.83
Rot. Bonds2

About 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide

5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide (PubChem CID 23073720) has the molecular formula C14H9ClF3NO2 and a molecular weight of 315.68 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide
PubChem CID23073720
Molecular FormulaC14H9ClF3NO2
Molecular Weight315.68 g/mol
Exact Mass315.03
IUPAC Name5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide
SMILESNC(=O)c1cc(Cl)cc(-c2ccc(C(F)(F)F)cc2)c1O
InChIInChI=1S/C14H9ClF3NO2/c15-9-5-10(12(20)11(6-9)13(19)21)7-1-3-8(4-2-7)14(16,17)18/h1-6,20H,(H2,19,21)
InChIKeyODDZYRABWRIPLF-UHFFFAOYSA-N
XLogP3.83
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.68
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide (CID 23073720) is 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide is NC(=O)c1cc(Cl)cc(-c2ccc(C(F)(F)F)cc2)c1O.
What is the InChIKey of 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide?
The InChIKey is ODDZYRABWRIPLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClF3NO2/c15-9-5-10(12(20)11(6-9)13(19)21)7-1-3-8(4-2-7)14(16,17)18/h1-6,20H,(H2,19,21).
What are the key properties of 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide?
5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide has a molecular weight of 315.68 g/mol, XLogP of 3.83, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-3-[4-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 23073720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).