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

C15H11ClF3NO2 — CID 167603991

IUPAC5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide
SMILESCc1ccc(NC(=O)c2cc(Cl)ccc2O)c(C(F)(F)F)c1
InChIInChI=1S/C15H11ClF3NO2/c1-8-2-4-12(11(6-8)15(17,18)19)20-14(22)10-7-9(16)3-5-13(10)21/h2-7,21H,1H3,(H,20,22)
InChIKeyRDTUMASMBMWZPO-UHFFFAOYSA-N
MW329.71 g/mol
LogP4.63
Rot. Bonds2

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

5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide (PubChem CID 167603991) has the molecular formula C15H11ClF3NO2 and a molecular weight of 329.71 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide
PubChem CID167603991
Molecular FormulaC15H11ClF3NO2
Molecular Weight329.71 g/mol
Exact Mass329.04
IUPAC Name5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide
SMILESCc1ccc(NC(=O)c2cc(Cl)ccc2O)c(C(F)(F)F)c1
InChIInChI=1S/C15H11ClF3NO2/c1-8-2-4-12(11(6-8)15(17,18)19)20-14(22)10-7-9(16)3-5-13(10)21/h2-7,21H,1H3,(H,20,22)
InChIKeyRDTUMASMBMWZPO-UHFFFAOYSA-N
XLogP4.63
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.71
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-chloro-2-(trifluoromethyl)phenyl]-4-methylbenzamide
CID 836769
[(2S)-1-[4-chloro-2-(trifluoromethyl)anilino]-1-oxopropan-2-yl] 2-hydroxy-5-methylbenzoate
CID 8958786
2-chloro-N-[4-chloro-2-(trifluoromethyl)phenyl]benzamide
CID 801601
N-[4-chloro-2-(trifluoromethyl)phenyl]-4,5-dimethylthiophene-3-carboxamide
CID 17172977
5-chloro-N-(2-fluoro-4-hydroxyphenyl)-2-hydroxybenzamide
CID 64793866
5-chloro-2-hydroxy-N-(2-methylphenyl)benzamide
CID 970572
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-methylpyridine-3-carboxamide
CID 110863795
N-[2-bromo-5-(trifluoromethyl)phenyl]-5-chloro-2-hydroxybenzamide
CID 71381236
N-[4-chloro-2-(trifluoromethyl)phenyl]-1-ethyl-6-methyl-4-oxoquinoline-3-carboxamide
CID 30132118
[2-[4-chloro-2-(trifluoromethyl)anilino]-2-oxoethyl] 5-chloro-2-hydroxybenzoate
CID 8850644
2,3-dichloro-N-[4-chloro-2-(trifluoromethyl)phenyl]benzamide
CID 2296110
N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide
CID 55083427

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide (CID 167603991) is 5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide is Cc1ccc(NC(=O)c2cc(Cl)ccc2O)c(C(F)(F)F)c1.
What is the InChIKey of 5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide?
The InChIKey is RDTUMASMBMWZPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClF3NO2/c1-8-2-4-12(11(6-8)15(17,18)19)20-14(22)10-7-9(16)3-5-13(10)21/h2-7,21H,1H3,(H,20,22).
What are the key properties of 5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide?
5-chloro-2-hydroxy-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide has a molecular weight of 329.71 g/mol, XLogP of 4.63, 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-N-[4-methyl-2-(trifluoromethyl)phenyl]benzamide is sourced from PubChem (CID 167603991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).