2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane

C12H22O3 — CID 66639597

IUPAC2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane
SMILESCC1(COCC2(C)CCCO2)CCCO1
InChIInChI=1S/C12H22O3/c1-11(5-3-7-14-11)9-13-10-12(2)6-4-8-15-12/h3-10H2,1-2H3
InChIKeyIHEVIULMSWDYBM-UHFFFAOYSA-N
MW214.30 g/mol
LogP2.14
Rot. Bonds4

About 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane

2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane (PubChem CID 66639597) has the molecular formula C12H22O3 and a molecular weight of 214.30 g/mol. Its IUPAC name is 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane.

Molecular Properties

Compound Name2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane
PubChem CID66639597
Molecular FormulaC12H22O3
Molecular Weight214.30 g/mol
Exact Mass214.16
IUPAC Name2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane
SMILESCC1(COCC2(C)CCCO2)CCCO1
InChIInChI=1S/C12H22O3/c1-11(5-3-7-14-11)9-13-10-12(2)6-4-8-15-12/h3-10H2,1-2H3
InChIKeyIHEVIULMSWDYBM-UHFFFAOYSA-N
XLogP2.14
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.30
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane?
The IUPAC name of 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane (CID 66639597) is 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane.
What is the SMILES notation for 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane?
The canonical SMILES for 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane is CC1(COCC2(C)CCCO2)CCCO1.
What is the InChIKey of 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane?
The InChIKey is IHEVIULMSWDYBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O3/c1-11(5-3-7-14-11)9-13-10-12(2)6-4-8-15-12/h3-10H2,1-2H3.
What are the key properties of 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane?
2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane has a molecular weight of 214.30 g/mol, XLogP of 2.14, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(2-methyloxolan-2-yl)methoxymethyl]oxolane is sourced from PubChem (CID 66639597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).