3-(2-propan-2-ylphenoxy)cyclohexan-1-ol

C15H22O2 — CID 79619454

IUPAC3-(2-propan-2-ylphenoxy)cyclohexan-1-ol
SMILESCC(C)c1ccccc1OC1CCCC(O)C1
InChIInChI=1S/C15H22O2/c1-11(2)14-8-3-4-9-15(14)17-13-7-5-6-12(16)10-13/h3-4,8-9,11-13,16H,5-7,10H2,1-2H3
InChIKeyMOLWUKTUWNRVAS-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.49
Rot. Bonds3

About 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol

3-(2-propan-2-ylphenoxy)cyclohexan-1-ol (PubChem CID 79619454) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol.

Molecular Properties

Compound Name3-(2-propan-2-ylphenoxy)cyclohexan-1-ol
PubChem CID79619454
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name3-(2-propan-2-ylphenoxy)cyclohexan-1-ol
SMILESCC(C)c1ccccc1OC1CCCC(O)C1
InChIInChI=1S/C15H22O2/c1-11(2)14-8-3-4-9-15(14)17-13-7-5-6-12(16)10-13/h3-4,8-9,11-13,16H,5-7,10H2,1-2H3
InChIKeyMOLWUKTUWNRVAS-UHFFFAOYSA-N
XLogP3.49
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-methoxycyclohexyl)oxy-2-propan-2-ylbenzene
CID 64764405
N-ethyl-3-(2-propan-2-ylphenoxy)cyclohexan-1-amine
CID 79618563
(1S)-1-[2-(3-methoxycyclohexyl)oxyphenyl]ethanol
CID 78958662
3-(3-methyl-4-propan-2-ylphenoxy)cyclohexan-1-ol
CID 79618028
1-(4-ethylcyclohexyl)oxy-2-propan-2-ylbenzene
CID 64763669
3-phenoxycyclohexan-1-ol
CID 79617811
3-(2-propan-2-ylphenoxy)cyclohexan-1-one
CID 79618145
(1S)-1-[2-(3-methylcyclohexyl)oxyphenyl]ethanamine
CID 78937930
2-(3-hydroxycyclohexyl)oxybenzonitrile
CID 117052783
3-(3-propan-2-ylphenoxy)cyclohexan-1-ol
CID 79618801
1-(2-cyclopentyloxyphenyl)propan-1-ol
CID 43503588
1-(2-cyclohexyloxyphenyl)-N-methylethanamine
CID 43279544

Frequently Asked Questions

What is the IUPAC name of 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol?
The IUPAC name of 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol (CID 79619454) is 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol.
What is the SMILES notation for 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol?
The canonical SMILES for 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol is CC(C)c1ccccc1OC1CCCC(O)C1.
What is the InChIKey of 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol?
The InChIKey is MOLWUKTUWNRVAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-11(2)14-8-3-4-9-15(14)17-13-7-5-6-12(16)10-13/h3-4,8-9,11-13,16H,5-7,10H2,1-2H3.
What are the key properties of 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol?
3-(2-propan-2-ylphenoxy)cyclohexan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-propan-2-ylphenoxy)cyclohexan-1-ol is sourced from PubChem (CID 79619454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).