4-(cyclopentylidenemethoxy)oxane

C11H18O2 — CID 176603057

IUPAC4-(cyclopentylidenemethoxy)oxane
SMILESC(OC1CCOCC1)=C1CCCC1
InChIInChI=1S/C11H18O2/c1-2-4-10(3-1)9-13-11-5-7-12-8-6-11/h9,11H,1-8H2
InChIKeyQXVBHQOIYCZKIQ-UHFFFAOYSA-N
MW182.26 g/mol
LogP2.64
Rot. Bonds2

About 4-(cyclopentylidenemethoxy)oxane

4-(cyclopentylidenemethoxy)oxane (PubChem CID 176603057) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is 4-(cyclopentylidenemethoxy)oxane.

Molecular Properties

Compound Name4-(cyclopentylidenemethoxy)oxane
PubChem CID176603057
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name4-(cyclopentylidenemethoxy)oxane
SMILESC(OC1CCOCC1)=C1CCCC1
InChIInChI=1S/C11H18O2/c1-2-4-10(3-1)9-13-11-5-7-12-8-6-11/h9,11H,1-8H2
InChIKeyQXVBHQOIYCZKIQ-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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Frequently Asked Questions

What is the IUPAC name of 4-(cyclopentylidenemethoxy)oxane?
The IUPAC name of 4-(cyclopentylidenemethoxy)oxane (CID 176603057) is 4-(cyclopentylidenemethoxy)oxane.
What is the SMILES notation for 4-(cyclopentylidenemethoxy)oxane?
The canonical SMILES for 4-(cyclopentylidenemethoxy)oxane is C(OC1CCOCC1)=C1CCCC1.
What is the InChIKey of 4-(cyclopentylidenemethoxy)oxane?
The InChIKey is QXVBHQOIYCZKIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2/c1-2-4-10(3-1)9-13-11-5-7-12-8-6-11/h9,11H,1-8H2.
What are the key properties of 4-(cyclopentylidenemethoxy)oxane?
4-(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 4-(cyclopentylidenemethoxy)oxane is sourced from PubChem (CID 176603057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).