2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane

C11H18O2 — CID 176603520

IUPAC2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane
SMILESCCC1(COC=C2CCCC2)CO1
InChIInChI=1S/C11H18O2/c1-2-11(9-13-11)8-12-7-10-5-3-4-6-10/h7H,2-6,8-9H2,1H3
InChIKeyUXWRNUWORRJPTB-UHFFFAOYSA-N
MW182.26 g/mol
LogP2.64
Rot. Bonds4

About 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane

2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane (PubChem CID 176603520) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane.

Molecular Properties

Compound Name2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane
PubChem CID176603520
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane
SMILESCCC1(COC=C2CCCC2)CO1
InChIInChI=1S/C11H18O2/c1-2-11(9-13-11)8-12-7-10-5-3-4-6-10/h7H,2-6,8-9H2,1H3
InChIKeyUXWRNUWORRJPTB-UHFFFAOYSA-N
XLogP2.64
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
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'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

2-Ethyl-2-(hex-1-enoxymethyl)oxirane
CID 118977542
2-(Cyclopentylidenemethoxymethyl)oxirane
CID 176603641
2-[2-(Cyclopentylidenemethoxy)ethyl]-2-methyl-1,4-dioxane
CID 176603690
2-Ethyl-2-(2-methylprop-1-enoxymethyl)oxirane
CID 176603818
2-(Cyclopentylidenemethoxymethyl)-2-methyloxirane
CID 176603955
2-(Cyclopentylidenemethoxymethyl)-2-ethyl-1,4-dioxane
CID 176604242
2-[1-(Cyclopentylidenemethoxy)ethyl]oxirane
CID 176604255
2-(Cyclohexylidenemethoxymethyl)-2-ethyloxirane
CID 176604663
2-[2-(Cyclopentylidenemethoxy)ethyl]-2-methyloxirane
CID 176605073

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane?
The IUPAC name of 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane (CID 176603520) is 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane.
What is the SMILES notation for 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane?
The canonical SMILES for 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane is CCC1(COC=C2CCCC2)CO1.
What is the InChIKey of 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane?
The InChIKey is UXWRNUWORRJPTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2/c1-2-11(9-13-11)8-12-7-10-5-3-4-6-10/h7H,2-6,8-9H2,1H3.
What are the key properties of 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane?
2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane has a molecular weight of 182.26 g/mol, XLogP of 2.64, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylidenemethoxymethyl)-2-ethyloxirane is sourced from PubChem (CID 176603520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).