2-[2-(cyclohexylidenemethoxy)ethyl]oxane

C14H24O2 — CID 176604143

IUPAC2-[2-(cyclohexylidenemethoxy)ethyl]oxane
SMILESC(OCCC1CCCCO1)=C1CCCCC1
InChIInChI=1S/C14H24O2/c1-2-6-13(7-3-1)12-15-11-9-14-8-4-5-10-16-14/h12,14H,1-11H2
InChIKeyRTOFLGTXSNIVJQ-UHFFFAOYSA-N
MW224.34 g/mol
LogP3.81
Rot. Bonds4

About 2-[2-(cyclohexylidenemethoxy)ethyl]oxane

2-[2-(cyclohexylidenemethoxy)ethyl]oxane (PubChem CID 176604143) has the molecular formula C14H24O2 and a molecular weight of 224.34 g/mol. Its IUPAC name is 2-[2-(cyclohexylidenemethoxy)ethyl]oxane.

Molecular Properties

Compound Name2-[2-(cyclohexylidenemethoxy)ethyl]oxane
PubChem CID176604143
Molecular FormulaC14H24O2
Molecular Weight224.34 g/mol
Exact Mass224.18
IUPAC Name2-[2-(cyclohexylidenemethoxy)ethyl]oxane
SMILESC(OCCC1CCCCO1)=C1CCCCC1
InChIInChI=1S/C14H24O2/c1-2-6-13(7-3-1)12-15-11-9-14-8-4-5-10-16-14/h12,14H,1-11H2
InChIKeyRTOFLGTXSNIVJQ-UHFFFAOYSA-N
XLogP3.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.34
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(Methoxymethylidene)-2,6-dimethyloxane
CID 58424345
(2R,6S)-4-(methoxymethylene)-2,6-dimethyltetrahydro-2H-pyran
CID 66936926
4-(4-Methylidenecyclohexyl)oxyoxane
CID 88984885
1-Ethoxy-4-(methoxymethylidene)cyclohexane
CID 118366710
3-(Cyclohexylidenemethoxy)oxocane
CID 176603020
2-[3-(Cyclohexylidenemethoxy)propyl]oxolane
CID 176603711
2-[1-(Cyclohexylidenemethoxy)ethyl]oxane
CID 176604355
2-[2-(Cyclopentylidenemethoxy)ethyl]oxane
CID 176604507
2-[3-(Cyclopentylidenemethoxy)propyl]oxane
CID 176604570
2-(Cyclohexylidenemethoxymethyl)oxane
CID 176604786
2-[2-(Cyclohexylidenemethoxy)ethyl]oxolane
CID 176604877
2-[2-(2-Methylprop-1-enoxy)ethyl]oxane
CID 176605169

Frequently Asked Questions

What is the IUPAC name of 2-[2-(cyclohexylidenemethoxy)ethyl]oxane?
The IUPAC name of 2-[2-(cyclohexylidenemethoxy)ethyl]oxane (CID 176604143) is 2-[2-(cyclohexylidenemethoxy)ethyl]oxane.
What is the SMILES notation for 2-[2-(cyclohexylidenemethoxy)ethyl]oxane?
The canonical SMILES for 2-[2-(cyclohexylidenemethoxy)ethyl]oxane is C(OCCC1CCCCO1)=C1CCCCC1.
What is the InChIKey of 2-[2-(cyclohexylidenemethoxy)ethyl]oxane?
The InChIKey is RTOFLGTXSNIVJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2/c1-2-6-13(7-3-1)12-15-11-9-14-8-4-5-10-16-14/h12,14H,1-11H2.
What are the key properties of 2-[2-(cyclohexylidenemethoxy)ethyl]oxane?
2-[2-(cyclohexylidenemethoxy)ethyl]oxane has a molecular weight of 224.34 g/mol, XLogP of 3.81, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(cyclohexylidenemethoxy)ethyl]oxane is sourced from PubChem (CID 176604143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).