2-cyclobutyl-1-(cycloocten-1-yl)ethanol

C14H24O — CID 106657591

IUPAC2-cyclobutyl-1-(cycloocten-1-yl)ethanol
SMILESOC(CC1CCC1)C1=CCCCCCC1
InChIInChI=1S/C14H24O/c15-14(11-12-7-6-8-12)13-9-4-2-1-3-5-10-13/h9,12,14-15H,1-8,10-11H2
InChIKeyOKVZPPJTHHXLJH-UHFFFAOYSA-N
MW208.34 g/mol
LogP3.82
Rot. Bonds3

About 2-cyclobutyl-1-(cycloocten-1-yl)ethanol

2-cyclobutyl-1-(cycloocten-1-yl)ethanol (PubChem CID 106657591) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is 2-cyclobutyl-1-(cycloocten-1-yl)ethanol.

Molecular Properties

Compound Name2-cyclobutyl-1-(cycloocten-1-yl)ethanol
PubChem CID106657591
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Name2-cyclobutyl-1-(cycloocten-1-yl)ethanol
SMILESOC(CC1CCC1)C1=CCCCCCC1
InChIInChI=1S/C14H24O/c15-14(11-12-7-6-8-12)13-9-4-2-1-3-5-10-13/h9,12,14-15H,1-8,10-11H2
InChIKeyOKVZPPJTHHXLJH-UHFFFAOYSA-N
XLogP3.82
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-1-(cycloocten-1-yl)ethanol?
The IUPAC name of 2-cyclobutyl-1-(cycloocten-1-yl)ethanol (CID 106657591) is 2-cyclobutyl-1-(cycloocten-1-yl)ethanol.
What is the SMILES notation for 2-cyclobutyl-1-(cycloocten-1-yl)ethanol?
The canonical SMILES for 2-cyclobutyl-1-(cycloocten-1-yl)ethanol is OC(CC1CCC1)C1=CCCCCCC1.
What is the InChIKey of 2-cyclobutyl-1-(cycloocten-1-yl)ethanol?
The InChIKey is OKVZPPJTHHXLJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c15-14(11-12-7-6-8-12)13-9-4-2-1-3-5-10-13/h9,12,14-15H,1-8,10-11H2.
What are the key properties of 2-cyclobutyl-1-(cycloocten-1-yl)ethanol?
2-cyclobutyl-1-(cycloocten-1-yl)ethanol has a molecular weight of 208.34 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-1-(cycloocten-1-yl)ethanol is sourced from PubChem (CID 106657591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).