5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid

C15H14O3 — CID 155571081

IUPAC5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid
SMILESCc1cc(O)cc(-c2ccc(C)c(C(=O)O)c2)c1
InChIInChI=1S/C15H14O3/c1-9-5-12(7-13(16)6-9)11-4-3-10(2)14(8-11)15(17)18/h3-8,16H,1-2H3,(H,17,18)
InChIKeyWPLUDODXMCLKSR-UHFFFAOYSA-N
MW242.27 g/mol
LogP3.37
Rot. Bonds2

About 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid

5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid (PubChem CID 155571081) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid.

Molecular Properties

Compound Name5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid
PubChem CID155571081
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid
SMILESCc1cc(O)cc(-c2ccc(C)c(C(=O)O)c2)c1
InChIInChI=1S/C15H14O3/c1-9-5-12(7-13(16)6-9)11-4-3-10(2)14(8-11)15(17)18/h3-8,16H,1-2H3,(H,17,18)
InChIKeyWPLUDODXMCLKSR-UHFFFAOYSA-N
XLogP3.37
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-5-(3-methylphenyl)benzoic acid
CID 65309585
4-(3-hydroxy-5-methylphenyl)benzoic acid
CID 53218919
2-methyl-5-[2-methyl-4-(trifluoromethyl)phenyl]benzoic acid
CID 102755397
1-[3-(3-hydroxy-5-methylphenyl)phenyl]ethanone
CID 53218902
2-amino-5-(4-amino-3-methylphenyl)benzoic acid
CID 143962907
2-hydroxy-4-(4-methylphenyl)benzoic acid
CID 53224890
2-methyl-5-thiophen-2-ylbenzoic acid
CID 65309680
2-chloro-5-(2,4,6-trimethylphenyl)benzoic acid
CID 54912541
3-carboxy-4-methylphenolate
CID 54720119
5-(2,4-dichlorophenyl)-2-methylbenzoic acid
CID 65307021
2-methyl-5-(1,3-oxazol-2-yl)benzoic acid
CID 170993673
CID 162313209
CID 162313209

Frequently Asked Questions

What is the IUPAC name of 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid?
The IUPAC name of 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid (CID 155571081) is 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid.
What is the SMILES notation for 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid?
The canonical SMILES for 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid is Cc1cc(O)cc(-c2ccc(C)c(C(=O)O)c2)c1.
What is the InChIKey of 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid?
The InChIKey is WPLUDODXMCLKSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3/c1-9-5-12(7-13(16)6-9)11-4-3-10(2)14(8-11)15(17)18/h3-8,16H,1-2H3,(H,17,18).
What are the key properties of 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid?
5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid has a molecular weight of 242.27 g/mol, XLogP of 3.37, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-hydroxy-5-methylphenyl)-2-methylbenzoic acid is sourced from PubChem (CID 155571081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).