3-[1-(cyclopentylidenemethoxy)ethyl]oxetane

C11H18O2 — CID 176602994

IUPAC3-[1-(cyclopentylidenemethoxy)ethyl]oxetane
SMILESCC(OC=C1CCCC1)C1COC1
InChIInChI=1S/C11H18O2/c1-9(11-7-12-8-11)13-6-10-4-2-3-5-10/h6,9,11H,2-5,7-8H2,1H3
InChIKeyPDDNRYUTBCNESG-UHFFFAOYSA-N
MW182.26 g/mol
LogP2.50
Rot. Bonds3

About 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane

3-[1-(cyclopentylidenemethoxy)ethyl]oxetane (PubChem CID 176602994) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane.

Molecular Properties

Compound Name3-[1-(cyclopentylidenemethoxy)ethyl]oxetane
PubChem CID176602994
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name3-[1-(cyclopentylidenemethoxy)ethyl]oxetane
SMILESCC(OC=C1CCCC1)C1COC1
InChIInChI=1S/C11H18O2/c1-9(11-7-12-8-11)13-6-10-4-2-3-5-10/h6,9,11H,2-5,7-8H2,1H3
InChIKeyPDDNRYUTBCNESG-UHFFFAOYSA-N
XLogP2.50
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[1-(2-Methylprop-1-enoxy)ethyl]oxetane
CID 176603608
3-[1-(Cyclohexylidenemethoxy)ethyl]oxetane
CID 176603931
3-[2-(Cyclopentylidenemethoxy)ethyl]oxetane
CID 176605026
3-(Cyclopentylidenemethoxymethyl)oxetane
CID 176605132
3-(Cyclopentylidenemethoxymethyl)-3-methyloxetane
CID 176605194
3-(Cyclopentylidenemethoxymethyl)-3-ethyloxetane
CID 176605346

Frequently Asked Questions

What is the IUPAC name of 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane?
The IUPAC name of 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane (CID 176602994) is 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane.
What is the SMILES notation for 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane?
The canonical SMILES for 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane is CC(OC=C1CCCC1)C1COC1.
What is the InChIKey of 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane?
The InChIKey is PDDNRYUTBCNESG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2/c1-9(11-7-12-8-11)13-6-10-4-2-3-5-10/h6,9,11H,2-5,7-8H2,1H3.
What are the key properties of 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane?
3-[1-(cyclopentylidenemethoxy)ethyl]oxetane has a molecular weight of 182.26 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(cyclopentylidenemethoxy)ethyl]oxetane is sourced from PubChem (CID 176602994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).