1-(cycloocten-1-yl)-2-cyclopropylethanol

C13H22O — CID 106657572

IUPAC1-(cycloocten-1-yl)-2-cyclopropylethanol
SMILESOC(CC1CC1)C1=CCCCCCC1
InChIInChI=1S/C13H22O/c14-13(10-11-8-9-11)12-6-4-2-1-3-5-7-12/h6,11,13-14H,1-5,7-10H2
InChIKeyHQEOKTJSTLWRJC-UHFFFAOYSA-N
MW194.32 g/mol
LogP3.43
Rot. Bonds3

About 1-(cycloocten-1-yl)-2-cyclopropylethanol

1-(cycloocten-1-yl)-2-cyclopropylethanol (PubChem CID 106657572) has the molecular formula C13H22O and a molecular weight of 194.32 g/mol. Its IUPAC name is 1-(cycloocten-1-yl)-2-cyclopropylethanol.

Molecular Properties

Compound Name1-(cycloocten-1-yl)-2-cyclopropylethanol
PubChem CID106657572
Molecular FormulaC13H22O
Molecular Weight194.32 g/mol
Exact Mass194.17
IUPAC Name1-(cycloocten-1-yl)-2-cyclopropylethanol
SMILESOC(CC1CC1)C1=CCCCCCC1
InChIInChI=1S/C13H22O/c14-13(10-11-8-9-11)12-6-4-2-1-3-5-7-12/h6,11,13-14H,1-5,7-10H2
InChIKeyHQEOKTJSTLWRJC-UHFFFAOYSA-N
XLogP3.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-cyclobutyl-1-(cycloocten-1-yl)ethanol
CID 106657591
2-cyclobutyl-1-(cyclohepten-1-yl)ethanol
CID 103165442
cycloocten-1-yl(cyclopropyl)methanol
CID 106651053
cyclohepten-1-yl(cyclopentyl)methanol
CID 62078752
1-(cycloocten-1-yl)-2-(oxolan-2-yl)ethanol
CID 106657616
1-(cyclohexen-1-yl)ethane-1,2-diol
CID 10964616
[1-(cyclohepten-1-yl)-2-cycloheptylethyl]hydrazine
CID 106650401
1-(cyclohexen-1-yl)-2-methylsulfanylethanol
CID 106657946
cyclohexen-1-ylmethanediol
CID 21392290
1-(cycloocten-1-yl)-4-ethoxybutan-1-ol
CID 106657695
1-(cyclohepten-1-yl)-3-ethylsulfanylpropan-1-ol
CID 106651633
1-(cycloocten-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 106657751

Frequently Asked Questions

What is the IUPAC name of 1-(cycloocten-1-yl)-2-cyclopropylethanol?
The IUPAC name of 1-(cycloocten-1-yl)-2-cyclopropylethanol (CID 106657572) is 1-(cycloocten-1-yl)-2-cyclopropylethanol.
What is the SMILES notation for 1-(cycloocten-1-yl)-2-cyclopropylethanol?
The canonical SMILES for 1-(cycloocten-1-yl)-2-cyclopropylethanol is OC(CC1CC1)C1=CCCCCCC1.
What is the InChIKey of 1-(cycloocten-1-yl)-2-cyclopropylethanol?
The InChIKey is HQEOKTJSTLWRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22O/c14-13(10-11-8-9-11)12-6-4-2-1-3-5-7-12/h6,11,13-14H,1-5,7-10H2.
What are the key properties of 1-(cycloocten-1-yl)-2-cyclopropylethanol?
1-(cycloocten-1-yl)-2-cyclopropylethanol has a molecular weight of 194.32 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cycloocten-1-yl)-2-cyclopropylethanol is sourced from PubChem (CID 106657572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).