1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol

C13H24O — CID 63863435

IUPAC1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol
SMILESCCC1CCCCC1C(C)(O)C1CC1
InChIInChI=1S/C13H24O/c1-3-10-6-4-5-7-12(10)13(2,14)11-8-9-11/h10-12,14H,3-9H2,1-2H3
InChIKeyGIMYBWCSPMSUFV-UHFFFAOYSA-N
MW196.33 g/mol
LogP3.36
Rot. Bonds3

About 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol

1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol (PubChem CID 63863435) has the molecular formula C13H24O and a molecular weight of 196.33 g/mol. Its IUPAC name is 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol
PubChem CID63863435
Molecular FormulaC13H24O
Molecular Weight196.33 g/mol
Exact Mass196.18
IUPAC Name1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol
SMILESCCC1CCCCC1C(C)(O)C1CC1
InChIInChI=1S/C13H24O/c1-3-10-6-4-5-7-12(10)13(2,14)11-8-9-11/h10-12,14H,3-9H2,1-2H3
InChIKeyGIMYBWCSPMSUFV-UHFFFAOYSA-N
XLogP3.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.33
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol?
The IUPAC name of 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol (CID 63863435) is 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol.
What is the SMILES notation for 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol?
The canonical SMILES for 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol is CCC1CCCCC1C(C)(O)C1CC1.
What is the InChIKey of 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol?
The InChIKey is GIMYBWCSPMSUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O/c1-3-10-6-4-5-7-12(10)13(2,14)11-8-9-11/h10-12,14H,3-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol?
1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol has a molecular weight of 196.33 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(2-ethylcyclohexyl)ethanol is sourced from PubChem (CID 63863435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).