2-(4-ethenylcyclohexyl)-5-methoxyoxane

C14H24O2 — CID 89184529

IUPAC2-(4-ethenylcyclohexyl)-5-methoxyoxane
SMILESC=CC1CCC(C2CCC(OC)CO2)CC1
InChIInChI=1S/C14H24O2/c1-3-11-4-6-12(7-5-11)14-9-8-13(15-2)10-16-14/h3,11-14H,1,4-10H2,2H3
InChIKeyUKDPOHWREZTRCK-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.17
Rot. Bonds3

About 2-(4-ethenylcyclohexyl)-5-methoxyoxane

2-(4-ethenylcyclohexyl)-5-methoxyoxane (PubChem CID 89184529) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 2-(4-ethenylcyclohexyl)-5-methoxyoxane.

Molecular Properties

Compound Name2-(4-ethenylcyclohexyl)-5-methoxyoxane
PubChem CID89184529
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name2-(4-ethenylcyclohexyl)-5-methoxyoxane
SMILESC=CC1CCC(C2CCC(OC)CO2)CC1
InChIInChI=1S/C14H24O2/c1-3-11-4-6-12(7-5-11)14-9-8-13(15-2)10-16-14/h3,11-14H,1,4-10H2,2H3
InChIKeyUKDPOHWREZTRCK-UHFFFAOYSA-N
XLogP3.17
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-(4-ethenylcyclohexyl)-5-methoxyoxane?
The IUPAC name of 2-(4-ethenylcyclohexyl)-5-methoxyoxane (CID 89184529) is 2-(4-ethenylcyclohexyl)-5-methoxyoxane.
What is the SMILES notation for 2-(4-ethenylcyclohexyl)-5-methoxyoxane?
The canonical SMILES for 2-(4-ethenylcyclohexyl)-5-methoxyoxane is C=CC1CCC(C2CCC(OC)CO2)CC1.
What is the InChIKey of 2-(4-ethenylcyclohexyl)-5-methoxyoxane?
The InChIKey is UKDPOHWREZTRCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-3-11-4-6-12(7-5-11)14-9-8-13(15-2)10-16-14/h3,11-14H,1,4-10H2,2H3.
What are the key properties of 2-(4-ethenylcyclohexyl)-5-methoxyoxane?
2-(4-ethenylcyclohexyl)-5-methoxyoxane has a molecular weight of 224.34 g/mol, XLogP of 3.17, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethenylcyclohexyl)-5-methoxyoxane is sourced from PubChem (CID 89184529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).