2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol

C16H22O — CID 116505508

IUPAC2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol
SMILESCC(O)(CC1CC1)c1ccc(C2CCC2)cc1
InChIInChI=1S/C16H22O/c1-16(17,11-12-5-6-12)15-9-7-14(8-10-15)13-3-2-4-13/h7-10,12-13,17H,2-6,11H2,1H3
InChIKeyUWCVYZUITDHGRE-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.96
Rot. Bonds4

About 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol

2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol (PubChem CID 116505508) has the molecular formula C16H22O and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol.

Molecular Properties

Compound Name2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol
PubChem CID116505508
Molecular FormulaC16H22O
Molecular Weight230.35 g/mol
Exact Mass230.17
IUPAC Name2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol
SMILESCC(O)(CC1CC1)c1ccc(C2CCC2)cc1
InChIInChI=1S/C16H22O/c1-16(17,11-12-5-6-12)15-9-7-14(8-10-15)13-3-2-4-13/h7-10,12-13,17H,2-6,11H2,1H3
InChIKeyUWCVYZUITDHGRE-UHFFFAOYSA-N
XLogP3.96
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-cyclobutylphenyl)butan-2-ol
CID 116505233
1-amino-2-(4-cyclobutylphenyl)propan-2-ol
CID 116505464
2-(4-tert-butylphenyl)-1-cyclobutylpropan-2-ol
CID 113490168
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-cyclobutyl-2-(3-fluoro-4-methylphenyl)propan-2-ol
CID 107128199

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol?
The IUPAC name of 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol (CID 116505508) is 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol.
What is the SMILES notation for 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol?
The canonical SMILES for 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol is CC(O)(CC1CC1)c1ccc(C2CCC2)cc1.
What is the InChIKey of 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol?
The InChIKey is UWCVYZUITDHGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22O/c1-16(17,11-12-5-6-12)15-9-7-14(8-10-15)13-3-2-4-13/h7-10,12-13,17H,2-6,11H2,1H3.
What are the key properties of 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol?
2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol has a molecular weight of 230.35 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol is sourced from PubChem (CID 116505508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).