N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide

C15H14FNO2 — CID 103887364

IUPACN-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide
SMILESCc1ccc(C)c(NC(=O)c2ccc(F)cc2O)c1
InChIInChI=1S/C15H14FNO2/c1-9-3-4-10(2)13(7-9)17-15(19)12-6-5-11(16)8-14(12)18/h3-8,18H,1-2H3,(H,17,19)
InChIKeyCAEJHHIIKTXXJI-UHFFFAOYSA-N
MW259.28 g/mol
LogP3.40
Rot. Bonds2

About N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide

N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide (PubChem CID 103887364) has the molecular formula C15H14FNO2 and a molecular weight of 259.28 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide
PubChem CID103887364
Molecular FormulaC15H14FNO2
Molecular Weight259.28 g/mol
Exact Mass259.10
IUPAC NameN-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide
SMILESCc1ccc(C)c(NC(=O)c2ccc(F)cc2O)c1
InChIInChI=1S/C15H14FNO2/c1-9-3-4-10(2)13(7-9)17-15(19)12-6-5-11(16)8-14(12)18/h3-8,18H,1-2H3,(H,17,19)
InChIKeyCAEJHHIIKTXXJI-UHFFFAOYSA-N
XLogP3.40
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-5-fluorophenyl)-2-hydroxy-4-methylbenzamide
CID 103753405
4-fluoro-2-hydroxy-N-(4-hydroxy-2-methylphenyl)benzamide
CID 103889353
4-fluoro-N-(2-fluoro-5-methylphenyl)-2-methylbenzamide
CID 112702327
N-(2-fluoro-4-methylphenyl)-2-hydroxy-4-methylbenzamide
CID 28881726
N-(2-chloro-5-methylphenyl)-2-hydroxy-4-methylbenzamide
CID 103769568
2,4-dichloro-N-(5-fluoro-2-methylphenyl)benzamide
CID 804177
N-(2-bromo-5-methylphenyl)-2,4-difluorobenzamide
CID 82706445
3-[(4-fluoro-2-hydroxybenzoyl)amino]-5-methyl-1H-pyrrole-2-carboxylic acid
CID 107013823
5-bromo-N-(5-fluoro-2-methylphenyl)-2-methylbenzamide
CID 65307346
5-fluoro-2-hydroxy-N-(4-hydroxy-2,5-dimethylphenyl)benzamide
CID 106834726
N-(5-fluoro-2-methylphenyl)-3-methylbenzamide
CID 4522552
4-fluoro-2-hydroxy-N-(1H-pyrazol-5-yl)benzamide
CID 103829854

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide?
The IUPAC name of N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide (CID 103887364) is N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide is Cc1ccc(C)c(NC(=O)c2ccc(F)cc2O)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide?
The InChIKey is CAEJHHIIKTXXJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO2/c1-9-3-4-10(2)13(7-9)17-15(19)12-6-5-11(16)8-14(12)18/h3-8,18H,1-2H3,(H,17,19).
What are the key properties of N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide?
N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide has a molecular weight of 259.28 g/mol, XLogP of 3.40, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-4-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 103887364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).