3-[1-(cyclohexylidenemethoxy)ethyl]oxane

Name: 3-[1-(cyclohexylidenemethoxy)ethyl]oxane — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₄H₂₄O₂ — CID 176605391

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3-[1-(cyclohexylidenemethoxy)ethyl]oxane

SMILESCC(OC=C1CCCCC1)C1CCCOC1

InChIInChI=1S/C14H24O2/c1-12(14-8-5-9-15-11-14)16-10-13-6-3-2-4-7-13/h10,12,14H,2-9,11H2,1H3

InChIKeyIGSBRTGCKPBPKN-UHFFFAOYSA-N

MW224.34 g/mol

LogP3.67

Rot. Bonds3

About 3-[1-(cyclohexylidenemethoxy)ethyl]oxane

3-[1-(cyclohexylidenemethoxy)ethyl]oxane (PubChem CID 176605391) has the molecular formula C₁₄H₂₄O₂ and a molecular weight of 224.34 g/mol. Its IUPAC name is 3-[1-(cyclohexylidenemethoxy)ethyl]oxane.

Molecular Properties

Compound Name	3-[1-(cyclohexylidenemethoxy)ethyl]oxane
PubChem CID	176605391
Molecular Formula	C₁₄H₂₄O₂
Molecular Weight	224.34 g/mol
Exact Mass	224.18
IUPAC Name	3-[1-(cyclohexylidenemethoxy)ethyl]oxane
SMILES	CC(OC=C1CCCCC1)C1CCCOC1
InChI	InChI=1S/C14H24O2/c1-12(14-8-5-9-15-11-14)16-10-13-6-3-2-4-7-13/h10,12,14H,2-9,11H2,1H3
InChIKey	IGSBRTGCKPBPKN-UHFFFAOYSA-N
XLogP	3.67
TPSA	18.46 Å²
H-Bond Donors
H-Bond Acceptors	2
Rotatable Bonds	3
Heavy Atoms	16
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	224.34
LogP ≤ 5	3.67
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

Structural Alerts	{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-[1-(cyclohexylidenemethoxy)ethyl]oxane?

The IUPAC name of 3-[1-(cyclohexylidenemethoxy)ethyl]oxane (CID 176605391) is 3-[1-(cyclohexylidenemethoxy)ethyl]oxane.

What is the SMILES notation for 3-[1-(cyclohexylidenemethoxy)ethyl]oxane?

The canonical SMILES for 3-[1-(cyclohexylidenemethoxy)ethyl]oxane is CC(OC=C1CCCCC1)C1CCCOC1.

What is the InChIKey of 3-[1-(cyclohexylidenemethoxy)ethyl]oxane?

The InChIKey is IGSBRTGCKPBPKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-12(14-8-5-9-15-11-14)16-10-13-6-3-2-4-7-13/h10,12,14H,2-9,11H2,1H3.

What are the key properties of 3-[1-(cyclohexylidenemethoxy)ethyl]oxane?

3-[1-(cyclohexylidenemethoxy)ethyl]oxane has a molecular weight of 224.34 g/mol, XLogP of 3.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[1-(cyclohexylidenemethoxy)ethyl]oxane is sourced from PubChem (CID 176605391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 176605391 — identifiers, structure, computed properties (public domain)

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