2-(3-propan-2-ylcyclobutyl)ethanol

C9H18O — CID 70261378

IUPAC2-(3-propan-2-ylcyclobutyl)ethanol
SMILESCC(C)C1CC(CCO)C1
InChIInChI=1S/C9H18O/c1-7(2)9-5-8(6-9)3-4-10/h7-10H,3-6H2,1-2H3
InChIKeyXMERVOKHUDDJGT-UHFFFAOYSA-N
MW142.24 g/mol
LogP2.05
Rot. Bonds3

About 2-(3-propan-2-ylcyclobutyl)ethanol

2-(3-propan-2-ylcyclobutyl)ethanol (PubChem CID 70261378) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is 2-(3-propan-2-ylcyclobutyl)ethanol.

Molecular Properties

Compound Name2-(3-propan-2-ylcyclobutyl)ethanol
PubChem CID70261378
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Name2-(3-propan-2-ylcyclobutyl)ethanol
SMILESCC(C)C1CC(CCO)C1
InChIInChI=1S/C9H18O/c1-7(2)9-5-8(6-9)3-4-10/h7-10H,3-6H2,1-2H3
InChIKeyXMERVOKHUDDJGT-UHFFFAOYSA-N
XLogP2.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-propan-2-ylcyclopentane-1,2-diol
CID 20608687
2-(3-methylcyclobutyl)ethanol
CID 59157244
3-[3-(2-hydroxyethyl)cyclopentyl]butan-1-ol
CID 67877346
2-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)ethanol
CID 171937168
1-ethyl-3,5-di(propan-2-yl)cyclohexane
CID 90833557
[(1R,3R)-3-propan-2-ylcyclopentyl]methanol
CID 59340916
1-(cyclopropylmethyl)-3-propan-2-ylcyclobutane
CID 91314606
2-[(5R)-6,6-dimethyl-3-bicyclo[3.1.1]heptanyl]ethanol
CID 89342976
2-(3-bicyclo[3.2.1]oct-6-enyl)ethanol
CID 13040771
2-[3,5-di(propan-2-yl)cyclohexyl]propan-1-ol
CID 139761097
(1R,3S,5S)-3-(2-methylpropyl)-5-propan-2-ylcyclohexan-1-ol
CID 6581896
trans-(1R,3R)-2-methyl-5-propan-2-ylcyclohexane-1,3-diol
CID 6431599

Frequently Asked Questions

What is the IUPAC name of 2-(3-propan-2-ylcyclobutyl)ethanol?
The IUPAC name of 2-(3-propan-2-ylcyclobutyl)ethanol (CID 70261378) is 2-(3-propan-2-ylcyclobutyl)ethanol.
What is the SMILES notation for 2-(3-propan-2-ylcyclobutyl)ethanol?
The canonical SMILES for 2-(3-propan-2-ylcyclobutyl)ethanol is CC(C)C1CC(CCO)C1.
What is the InChIKey of 2-(3-propan-2-ylcyclobutyl)ethanol?
The InChIKey is XMERVOKHUDDJGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O/c1-7(2)9-5-8(6-9)3-4-10/h7-10H,3-6H2,1-2H3.
What are the key properties of 2-(3-propan-2-ylcyclobutyl)ethanol?
2-(3-propan-2-ylcyclobutyl)ethanol has a molecular weight of 142.24 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propan-2-ylcyclobutyl)ethanol is sourced from PubChem (CID 70261378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).