N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide

C15H11ClF3NO2 — CID 167685587

IUPACN-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide
SMILESCc1cc(Cl)cc(NC(=O)c2ccc(C(F)(F)F)cc2O)c1
InChIInChI=1S/C15H11ClF3NO2/c1-8-4-10(16)7-11(5-8)20-14(22)12-3-2-9(6-13(12)21)15(17,18)19/h2-7,21H,1H3,(H,20,22)
InChIKeyIWJAZYAVNKOKAB-UHFFFAOYSA-N
MW329.71 g/mol
LogP4.63
Rot. Bonds2

About N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide

N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide (PubChem CID 167685587) has the molecular formula C15H11ClF3NO2 and a molecular weight of 329.71 g/mol. Its IUPAC name is N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide
PubChem CID167685587
Molecular FormulaC15H11ClF3NO2
Molecular Weight329.71 g/mol
Exact Mass329.04
IUPAC NameN-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide
SMILESCc1cc(Cl)cc(NC(=O)c2ccc(C(F)(F)F)cc2O)c1
InChIInChI=1S/C15H11ClF3NO2/c1-8-4-10(16)7-11(5-8)20-14(22)12-3-2-9(6-13(12)21)15(17,18)19/h2-7,21H,1H3,(H,20,22)
InChIKeyIWJAZYAVNKOKAB-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

2-hydroxy-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 154341283
N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3-bromo-5-methylphenyl)-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3-bromo-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide;N-(3-chloro-5-methylphenyl)-2-hydroxy-5-iodobenzamide;3,5-dichloro-N-(3-chloro-5-methylphenyl)-2-hydroxybenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide;N-(3-fluoro-5-methylphenyl)-2-hydroxy-5-iodobenzamide
CID 167701625
N-[3-chloro-5-(trifluoromethyl)phenyl]-3-hydroxypyridine-4-carboxamide
CID 116700273
4,5-dichloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
CID 134151897
5-bromo-4-chloro-2-hydroxy-N-[4-(trifluoromethyl)phenyl]benzamide
CID 134146320
N-[2,5-bis(trifluoromethyl)phenyl]-5-bromo-2-hydroxybenzamide;5-bromo-N-(3,5-dimethylphenyl)-2-hydroxybenzamide;N-(3,5-dibromophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dichlorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-difluorophenyl)-2-hydroxy-5-iodobenzamide;N-(3,5-dimethylphenyl)-2-hydroxy-5-iodobenzamide
CID 167585391
2-[[3-chloro-5-(trifluoromethyl)phenyl]carbamoyl]benzoic acid
CID 85472840
N-[3-bromo-5-(trifluoromethyl)phenyl]-5-chloro-2-hydroxybenzamide
CID 71381238
1-[2-hydroxy-4-(trifluoromethyl)phenyl]-2-(methylamino)ethanone
CID 84696388
2-bromo-N-(2-methyl-4-pyridinyl)-4-(trifluoromethyl)benzamide
CID 154990210
2,5-dichloro-N-(3,5-dimethylphenyl)benzamide
CID 965625
4-chloro-N-(3,5-dimethylphenyl)-2-iodobenzamide
CID 38898615

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide?
The IUPAC name of N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide (CID 167685587) is N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide.
What is the SMILES notation for N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide?
The canonical SMILES for N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide is Cc1cc(Cl)cc(NC(=O)c2ccc(C(F)(F)F)cc2O)c1.
What is the InChIKey of N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide?
The InChIKey is IWJAZYAVNKOKAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClF3NO2/c1-8-4-10(16)7-11(5-8)20-14(22)12-3-2-9(6-13(12)21)15(17,18)19/h2-7,21H,1H3,(H,20,22).
What are the key properties of N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide?
N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)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 N-(3-chloro-5-methylphenyl)-2-hydroxy-4-(trifluoromethyl)benzamide is sourced from PubChem (CID 167685587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).