(3-ethylcyclopentyl)cyclohexane

C13H24 — CID 142208206

IUPAC(3-ethylcyclopentyl)cyclohexane
SMILESCCC1CCC(C2CCCCC2)C1
InChIInChI=1S/C13H24/c1-2-11-8-9-13(10-11)12-6-4-3-5-7-12/h11-13H,2-10H2,1H3
InChIKeySMZBXFCSOAOPEG-UHFFFAOYSA-N
MW180.33 g/mol
LogP4.39
Rot. Bonds2

About (3-ethylcyclopentyl)cyclohexane

(3-ethylcyclopentyl)cyclohexane (PubChem CID 142208206) has the molecular formula C13H24 and a molecular weight of 180.33 g/mol. Its IUPAC name is (3-ethylcyclopentyl)cyclohexane.

Molecular Properties

Compound Name(3-ethylcyclopentyl)cyclohexane
PubChem CID142208206
Molecular FormulaC13H24
Molecular Weight180.33 g/mol
Exact Mass180.19
IUPAC Name(3-ethylcyclopentyl)cyclohexane
SMILESCCC1CCC(C2CCCCC2)C1
InChIInChI=1S/C13H24/c1-2-11-8-9-13(10-11)12-6-4-3-5-7-12/h11-13H,2-10H2,1H3
InChIKeySMZBXFCSOAOPEG-UHFFFAOYSA-N
XLogP4.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.33
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (3-ethylcyclopentyl)cyclohexane?
The IUPAC name of (3-ethylcyclopentyl)cyclohexane (CID 142208206) is (3-ethylcyclopentyl)cyclohexane.
What is the SMILES notation for (3-ethylcyclopentyl)cyclohexane?
The canonical SMILES for (3-ethylcyclopentyl)cyclohexane is CCC1CCC(C2CCCCC2)C1.
What is the InChIKey of (3-ethylcyclopentyl)cyclohexane?
The InChIKey is SMZBXFCSOAOPEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24/c1-2-11-8-9-13(10-11)12-6-4-3-5-7-12/h11-13H,2-10H2,1H3.
What are the key properties of (3-ethylcyclopentyl)cyclohexane?
(3-ethylcyclopentyl)cyclohexane has a molecular weight of 180.33 g/mol, XLogP of 4.39, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylcyclopentyl)cyclohexane is sourced from PubChem (CID 142208206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).