4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol

C15H22O — CID 116928416

IUPAC4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol
SMILESCc1ccc(C)c(CC2CCC(O)CC2)c1
InChIInChI=1S/C15H22O/c1-11-3-4-12(2)14(9-11)10-13-5-7-15(16)8-6-13/h3-4,9,13,15-16H,5-8,10H2,1-2H3
InChIKeyRQHJGHWXRBQGML-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.40
Rot. Bonds2

About 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol

4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol (PubChem CID 116928416) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol
PubChem CID116928416
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol
SMILESCc1ccc(C)c(CC2CCC(O)CC2)c1
InChIInChI=1S/C15H22O/c1-11-3-4-12(2)14(9-11)10-13-5-7-15(16)8-6-13/h3-4,9,13,15-16H,5-8,10H2,1-2H3
InChIKeyRQHJGHWXRBQGML-UHFFFAOYSA-N
XLogP3.40
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol 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-[(4-hydroxycyclohexyl)methyl]-4,6-dimethylphenol
CID 123388666
4-[(2,5-dimethylphenyl)methyl-methylamino]cyclohexan-1-ol
CID 115149515
1-(cyclopropylmethyl)-2,4-dimethylbenzene
CID 156717993
2-[(2,5-dimethylphenyl)methyl]oxirane
CID 14045723
N-(cyclopropylmethyl)-2-(2,5-dimethylphenyl)ethanamine
CID 62538182
2-[(2,5-dimethylphenyl)methyl]-4-ethylcyclohexan-1-amine
CID 55185587
1,6-dimethyl-4-[(4-methylcyclohexyl)methyl]naphthalene
CID 123270650
4-[[(2-methoxy-5-methylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 106126443
4-[[(2,5-dimethylphenyl)methylamino]methyl]cyclohexan-1-amine
CID 115213416
1-[(2,5-dimethylphenyl)methyl]pyrrolidin-3-ol
CID 24904964
2-[(2-bromocyclopentyl)methyl]-1,4-dimethylbenzene
CID 63471595
4-[3-(2-chloro-4-methylphenyl)propyl]cyclohexan-1-ol
CID 70259668

Frequently Asked Questions

What is the IUPAC name of 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol?
The IUPAC name of 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol (CID 116928416) is 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol is Cc1ccc(C)c(CC2CCC(O)CC2)c1.
What is the InChIKey of 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol?
The InChIKey is RQHJGHWXRBQGML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-11-3-4-12(2)14(9-11)10-13-5-7-15(16)8-6-13/h3-4,9,13,15-16H,5-8,10H2,1-2H3.
What are the key properties of 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol?
4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol has a molecular weight of 218.34 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,5-dimethylphenyl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 116928416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).