1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol

C16H24O — CID 62607509

IUPAC1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol
SMILESCc1cc(C)cc(CC(O)CC2CCCC2)c1
InChIInChI=1S/C16H24O/c1-12-7-13(2)9-15(8-12)11-16(17)10-14-5-3-4-6-14/h7-9,14,16-17H,3-6,10-11H2,1-2H3
InChIKeyUJSFOFKIKAMHPS-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.79
Rot. Bonds4

About 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol

1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol (PubChem CID 62607509) has the molecular formula C16H24O and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol
PubChem CID62607509
Molecular FormulaC16H24O
Molecular Weight232.37 g/mol
Exact Mass232.18
IUPAC Name1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol
SMILESCc1cc(C)cc(CC(O)CC2CCCC2)c1
InChIInChI=1S/C16H24O/c1-12-7-13(2)9-15(8-12)11-16(17)10-14-5-3-4-6-14/h7-9,14,16-17H,3-6,10-11H2,1-2H3
InChIKeyUJSFOFKIKAMHPS-UHFFFAOYSA-N
XLogP3.79
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-cyclohexyl-1-(3,5-dimethylphenyl)butan-2-ol
CID 114980328
1,3-bis(3,5-dimethylphenyl)propan-2-ol
CID 63411020
1-cyclopentyl-3-(3,4-dichlorophenyl)propan-2-ol
CID 63411016
1-(4-tert-butyl-2,6-dimethylphenyl)-3-cyclopentylpropan-2-ol
CID 63410441
1-cyclobutyl-3-pyridin-4-ylpropan-2-ol
CID 65457180
4-cyclopentyl-1-(3-methylphenyl)butan-2-ol
CID 55149919
2-(3,5-dimethylphenyl)-1-(4-ethylcyclohexyl)ethanol
CID 64776027
1-cyclopentyl-3-[(3-methylphenyl)methylsulfanyl]propan-2-ol
CID 103160784
1-(4-chlorophenyl)-3-cyclobutylpropan-2-ol
CID 65457870
1-cycloheptyl-3-(2-methylphenyl)propan-2-ol
CID 114458939
carbanide;bis(1-(cyclopentylmethyl)-3,5-dimethylbenzene);dichlorozirconium(2+)
CID 162285999
1-cyclohexyl-3-pyridin-3-ylpropan-2-ol
CID 62605827

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol?
The IUPAC name of 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol (CID 62607509) is 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol is Cc1cc(C)cc(CC(O)CC2CCCC2)c1.
What is the InChIKey of 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol?
The InChIKey is UJSFOFKIKAMHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O/c1-12-7-13(2)9-15(8-12)11-16(17)10-14-5-3-4-6-14/h7-9,14,16-17H,3-6,10-11H2,1-2H3.
What are the key properties of 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol?
1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol has a molecular weight of 232.37 g/mol, XLogP of 3.79, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(3,5-dimethylphenyl)propan-2-ol is sourced from PubChem (CID 62607509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).