2-(4-cyclobutylphenyl)butan-2-ol

C14H20O — CID 116505233

IUPAC2-(4-cyclobutylphenyl)butan-2-ol
SMILESCCC(C)(O)c1ccc(C2CCC2)cc1
InChIInChI=1S/C14H20O/c1-3-14(2,15)13-9-7-12(8-10-13)11-5-4-6-11/h7-11,15H,3-6H2,1-2H3
InChIKeyTWIXVNFEASUCMR-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.57
Rot. Bonds3

About 2-(4-cyclobutylphenyl)butan-2-ol

2-(4-cyclobutylphenyl)butan-2-ol (PubChem CID 116505233) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 2-(4-cyclobutylphenyl)butan-2-ol.

Molecular Properties

Compound Name2-(4-cyclobutylphenyl)butan-2-ol
PubChem CID116505233
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name2-(4-cyclobutylphenyl)butan-2-ol
SMILESCCC(C)(O)c1ccc(C2CCC2)cc1
InChIInChI=1S/C14H20O/c1-3-14(2,15)13-9-7-12(8-10-13)11-5-4-6-11/h7-11,15H,3-6H2,1-2H3
InChIKeyTWIXVNFEASUCMR-UHFFFAOYSA-N
XLogP3.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-amino-2-(4-cyclobutylphenyl)propan-2-ol
CID 116505464
2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol
CID 116505508
1-(tert-butylamino)-2-(4-cyclobutylphenyl)propan-2-ol
CID 116507022
2-(4-cyclobutylphenyl)-3,3-dimethylbutan-2-ol
CID 116505450
2-(4-cyclobutylphenyl)-1-(cyclopropylamino)propan-2-ol
CID 116507021
2-(4-cyclobutylphenyl)-2-hydroxypropanal
CID 116505401
2-(4-cyclobutylphenyl)-4,4-dimethoxybutan-2-ol
CID 116505399
4-[1-(4-cyclobutylphenyl)-1-hydroxyethyl]phenol
CID 116505479
1-(4-cyclopropylphenyl)ethane-1,1-diol
CID 91219710
1-cyclohexyl-4-(2-hydroperoxypropan-2-yl)benzene
CID 24843348
1-(4-cyclobutylphenyl)-2-(dimethylamino)-2-methylbutan-1-ol
CID 116505815
1-(4-cyclobutylphenyl)-1-piperidin-3-ylethanol
CID 116505257

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclobutylphenyl)butan-2-ol?
The IUPAC name of 2-(4-cyclobutylphenyl)butan-2-ol (CID 116505233) is 2-(4-cyclobutylphenyl)butan-2-ol.
What is the SMILES notation for 2-(4-cyclobutylphenyl)butan-2-ol?
The canonical SMILES for 2-(4-cyclobutylphenyl)butan-2-ol is CCC(C)(O)c1ccc(C2CCC2)cc1.
What is the InChIKey of 2-(4-cyclobutylphenyl)butan-2-ol?
The InChIKey is TWIXVNFEASUCMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-3-14(2,15)13-9-7-12(8-10-13)11-5-4-6-11/h7-11,15H,3-6H2,1-2H3.
What are the key properties of 2-(4-cyclobutylphenyl)butan-2-ol?
2-(4-cyclobutylphenyl)butan-2-ol has a molecular weight of 204.31 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclobutylphenyl)butan-2-ol is sourced from PubChem (CID 116505233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).