3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane

C14H24O3 — CID 123470169

IUPAC3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane
SMILESC=C1COC(C2CCCC2COC)C1COC
InChIInChI=1S/C14H24O3/c1-10-7-17-14(13(10)9-16-3)12-6-4-5-11(12)8-15-2/h11-14H,1,4-9H2,2-3H3
InChIKeyDYUMMTRYPDCDHJ-UHFFFAOYSA-N
MW240.34 g/mol
LogP2.27
Rot. Bonds5

About 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane

3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane (PubChem CID 123470169) has the molecular formula C14H24O3 and a molecular weight of 240.34 g/mol. Its IUPAC name is 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane.

Molecular Properties

Compound Name3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane
PubChem CID123470169
Molecular FormulaC14H24O3
Molecular Weight240.34 g/mol
Exact Mass240.17
IUPAC Name3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane
SMILESC=C1COC(C2CCCC2COC)C1COC
InChIInChI=1S/C14H24O3/c1-10-7-17-14(13(10)9-16-3)12-6-4-5-11(12)8-15-2/h11-14H,1,4-9H2,2-3H3
InChIKeyDYUMMTRYPDCDHJ-UHFFFAOYSA-N
XLogP2.27
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.34
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane?
The IUPAC name of 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane (CID 123470169) is 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane.
What is the SMILES notation for 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane?
The canonical SMILES for 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane is C=C1COC(C2CCCC2COC)C1COC.
What is the InChIKey of 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane?
The InChIKey is DYUMMTRYPDCDHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O3/c1-10-7-17-14(13(10)9-16-3)12-6-4-5-11(12)8-15-2/h11-14H,1,4-9H2,2-3H3.
What are the key properties of 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane?
3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane has a molecular weight of 240.34 g/mol, XLogP of 2.27, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-2-[2-(methoxymethyl)cyclopentyl]-4-methylideneoxolane is sourced from PubChem (CID 123470169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).