2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane

C13H24O2 — CID 23594562

IUPAC2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane
SMILESCOCC1CCC(C2(C)CCCCC2)O1
InChIInChI=1S/C13H24O2/c1-13(8-4-3-5-9-13)12-7-6-11(15-12)10-14-2/h11-12H,3-10H2,1-2H3
InChIKeyFIBCNOJXCCQGSD-UHFFFAOYSA-N
MW212.33 g/mol
LogP3.15
Rot. Bonds3

About 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane

2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane (PubChem CID 23594562) has the molecular formula C13H24O2 and a molecular weight of 212.33 g/mol. Its IUPAC name is 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane.

Molecular Properties

Compound Name2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane
PubChem CID23594562
Molecular FormulaC13H24O2
Molecular Weight212.33 g/mol
Exact Mass212.18
IUPAC Name2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane
SMILESCOCC1CCC(C2(C)CCCCC2)O1
InChIInChI=1S/C13H24O2/c1-13(8-4-3-5-9-13)12-7-6-11(15-12)10-14-2/h11-12H,3-10H2,1-2H3
InChIKeyFIBCNOJXCCQGSD-UHFFFAOYSA-N
XLogP3.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.33
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane?
The IUPAC name of 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane (CID 23594562) is 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane.
What is the SMILES notation for 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane?
The canonical SMILES for 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane is COCC1CCC(C2(C)CCCCC2)O1.
What is the InChIKey of 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane?
The InChIKey is FIBCNOJXCCQGSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O2/c1-13(8-4-3-5-9-13)12-7-6-11(15-12)10-14-2/h11-12H,3-10H2,1-2H3.
What are the key properties of 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane?
2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane has a molecular weight of 212.33 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-5-(1-methylcyclohexyl)oxolane is sourced from PubChem (CID 23594562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).