2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride

C8H7ClF3NO2 — CID 141021225

IUPAC2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride
SMILESCl.NC(=O)c1cccc(C(F)(F)F)c1O
InChIInChI=1S/C8H6F3NO2.ClH/c9-8(10,11)5-3-1-2-4(6(5)13)7(12)14;/h1-3,13H,(H2,12,14);1H
InChIKeyGCTGXPZWAAHHBQ-UHFFFAOYSA-N
MW241.60 g/mol
LogP1.93
Rot. Bonds1

About 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride

2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride (PubChem CID 141021225) has the molecular formula C8H7ClF3NO2 and a molecular weight of 241.60 g/mol. Its IUPAC name is 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride.

Molecular Properties

Compound Name2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride
PubChem CID141021225
Molecular FormulaC8H7ClF3NO2
Molecular Weight241.60 g/mol
Exact Mass241.01
IUPAC Name2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride
SMILESCl.NC(=O)c1cccc(C(F)(F)F)c1O
InChIInChI=1S/C8H6F3NO2.ClH/c9-8(10,11)5-3-1-2-4(6(5)13)7(12)14;/h1-3,13H,(H2,12,14);1H
InChIKeyGCTGXPZWAAHHBQ-UHFFFAOYSA-N
XLogP1.93
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.60
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride?
The IUPAC name of 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride (CID 141021225) is 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride.
What is the SMILES notation for 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride?
The canonical SMILES for 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride is Cl.NC(=O)c1cccc(C(F)(F)F)c1O.
What is the InChIKey of 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride?
The InChIKey is GCTGXPZWAAHHBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F3NO2.ClH/c9-8(10,11)5-3-1-2-4(6(5)13)7(12)14;/h1-3,13H,(H2,12,14);1H.
What are the key properties of 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride?
2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride has a molecular weight of 241.60 g/mol, XLogP of 1.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-(trifluoromethyl)benzamide;hydrochloride is sourced from PubChem (CID 141021225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).