1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol

C15H22O2 — CID 105129139

IUPAC1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol
SMILESCC(C)OCC(O)c1ccc(C2CCC2)cc1
InChIInChI=1S/C15H22O2/c1-11(2)17-10-15(16)14-8-6-13(7-9-14)12-4-3-5-12/h6-9,11-12,15-16H,3-5,10H2,1-2H3
InChIKeyQWNIBHFUQCLOFU-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.41
Rot. Bonds5

About 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol

1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol (PubChem CID 105129139) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol.

Molecular Properties

Compound Name1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol
PubChem CID105129139
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol
SMILESCC(C)OCC(O)c1ccc(C2CCC2)cc1
InChIInChI=1S/C15H22O2/c1-11(2)17-10-15(16)14-8-6-13(7-9-14)12-4-3-5-12/h6-9,11-12,15-16H,3-5,10H2,1-2H3
InChIKeyQWNIBHFUQCLOFU-UHFFFAOYSA-N
XLogP3.41
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-aminooxy-1-(4-cyclohexylphenyl)ethanol
CID 82116649
1-(4-fluorophenyl)-2-propan-2-yloxyethanol
CID 79567387
1-(4-cyclobutylphenyl)-2,2-diethoxyethanol
CID 116505826
2-(4-cyclobutylphenyl)propan-1-amine
CID 116507054
1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanone
CID 105131775
2-bromo-1-(4-cyclohexylphenyl)ethanol
CID 116863188
2-amino-1-(4-cyclohexylphenyl)ethanol
CID 82114264
1-(4-cyclopentylphenyl)hexan-1-ol
CID 91233072
1-(4-cyclobutylphenyl)-2-methylbutan-1-amine
CID 116506106
1-(4-cyclobutylphenyl)-2-(3-methylphenyl)ethanol
CID 116505746
1-(4-cyclobutylphenyl)-3-phenoxypropan-1-ol
CID 116505724
1-(4-cyclohexylphenyl)octan-1-ol
CID 63426970

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol?
The IUPAC name of 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol (CID 105129139) is 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol.
What is the SMILES notation for 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol?
The canonical SMILES for 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol is CC(C)OCC(O)c1ccc(C2CCC2)cc1.
What is the InChIKey of 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol?
The InChIKey is QWNIBHFUQCLOFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-11(2)17-10-15(16)14-8-6-13(7-9-14)12-4-3-5-12/h6-9,11-12,15-16H,3-5,10H2,1-2H3.
What are the key properties of 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol?
1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol has a molecular weight of 234.34 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanol is sourced from PubChem (CID 105129139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).