2-(2-methylcyclopent-2-en-1-yl)oxyoxane

C11H18O2 — CID 123676499

IUPAC2-(2-methylcyclopent-2-en-1-yl)oxyoxane
SMILESCC1=CCCC1OC1CCCCO1
InChIInChI=1S/C11H18O2/c1-9-5-4-6-10(9)13-11-7-2-3-8-12-11/h5,10-11H,2-4,6-8H2,1H3
InChIKeyYZXPBYPBDFLCCM-UHFFFAOYSA-N
MW182.26 g/mol
LogP2.64
Rot. Bonds2

About 2-(2-methylcyclopent-2-en-1-yl)oxyoxane

2-(2-methylcyclopent-2-en-1-yl)oxyoxane (PubChem CID 123676499) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is 2-(2-methylcyclopent-2-en-1-yl)oxyoxane.

Molecular Properties

Compound Name2-(2-methylcyclopent-2-en-1-yl)oxyoxane
PubChem CID123676499
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name2-(2-methylcyclopent-2-en-1-yl)oxyoxane
SMILESCC1=CCCC1OC1CCCCO1
InChIInChI=1S/C11H18O2/c1-9-5-4-6-10(9)13-11-7-2-3-8-12-11/h5,10-11H,2-4,6-8H2,1H3
InChIKeyYZXPBYPBDFLCCM-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': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylcyclopent-2-en-1-yl)oxyoxane?
The IUPAC name of 2-(2-methylcyclopent-2-en-1-yl)oxyoxane (CID 123676499) is 2-(2-methylcyclopent-2-en-1-yl)oxyoxane.
What is the SMILES notation for 2-(2-methylcyclopent-2-en-1-yl)oxyoxane?
The canonical SMILES for 2-(2-methylcyclopent-2-en-1-yl)oxyoxane is CC1=CCCC1OC1CCCCO1.
What is the InChIKey of 2-(2-methylcyclopent-2-en-1-yl)oxyoxane?
The InChIKey is YZXPBYPBDFLCCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2/c1-9-5-4-6-10(9)13-11-7-2-3-8-12-11/h5,10-11H,2-4,6-8H2,1H3.
What are the key properties of 2-(2-methylcyclopent-2-en-1-yl)oxyoxane?
2-(2-methylcyclopent-2-en-1-yl)oxyoxane 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 2-(2-methylcyclopent-2-en-1-yl)oxyoxane is sourced from PubChem (CID 123676499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).