3-(cyclopentylidenemethoxy)oxane

C11H18O2 — CID 176604530

IUPAC3-(cyclopentylidenemethoxy)oxane
SMILESC(OC1CCCOC1)=C1CCCC1
InChIInChI=1S/C11H18O2/c1-2-5-10(4-1)8-13-11-6-3-7-12-9-11/h8,11H,1-7,9H2
InChIKeyASZDPAIWPMIOEM-UHFFFAOYSA-N
MW182.26 g/mol
LogP2.64
Rot. Bonds2

About 3-(cyclopentylidenemethoxy)oxane

3-(cyclopentylidenemethoxy)oxane (PubChem CID 176604530) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is 3-(cyclopentylidenemethoxy)oxane.

Molecular Properties

Compound Name3-(cyclopentylidenemethoxy)oxane
PubChem CID176604530
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name3-(cyclopentylidenemethoxy)oxane
SMILESC(OC1CCCOC1)=C1CCCC1
InChIInChI=1S/C11H18O2/c1-2-5-10(4-1)8-13-11-6-3-7-12-9-11/h8,11H,1-7,9H2
InChIKeyASZDPAIWPMIOEM-UHFFFAOYSA-N
XLogP2.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 52.64
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

4-(Cyclopentylidenemethoxy)oxane
CID 176603057
3-(Cyclohexylidenemethoxy)oxane
CID 176603061
2-[1-(Cyclopentylidenemethoxy)ethyl]oxane
CID 176603211
2-(Cyclopentylidenemethoxymethyl)oxane
CID 176603363
2-[2-(Cyclopentylidenemethoxy)ethyl]-2-methyl-1,4-dioxane
CID 176603690
2-(Cyclopentylidenemethoxymethyl)-1,4-dioxane
CID 176603998
3-(2-Methylprop-1-enoxy)oxane
CID 176604011
2-[2-(Cyclopentylidenemethoxy)ethyl]-1,4-dioxane
CID 176604070
4-[1-(Cyclopentylidenemethoxy)ethyl]oxane
CID 176604681
2-[3-(Cyclopentylidenemethoxy)propyl]-1,4-dioxane
CID 176604757
2-[1-(Cyclopentylidenemethoxy)ethyl]-1,4-dioxane
CID 176605283

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylidenemethoxy)oxane?
The IUPAC name of 3-(cyclopentylidenemethoxy)oxane (CID 176604530) is 3-(cyclopentylidenemethoxy)oxane.
What is the SMILES notation for 3-(cyclopentylidenemethoxy)oxane?
The canonical SMILES for 3-(cyclopentylidenemethoxy)oxane is C(OC1CCCOC1)=C1CCCC1.
What is the InChIKey of 3-(cyclopentylidenemethoxy)oxane?
The InChIKey is ASZDPAIWPMIOEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2/c1-2-5-10(4-1)8-13-11-6-3-7-12-9-11/h8,11H,1-7,9H2.
What are the key properties of 3-(cyclopentylidenemethoxy)oxane?
3-(cyclopentylidenemethoxy)oxane has a molecular weight of 182.26 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylidenemethoxy)oxane is sourced from PubChem (CID 176604530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).