3,3,5-trimethyl-2-methylideneoxolane

C8H14O — CID 67949108

IUPAC3,3,5-trimethyl-2-methylideneoxolane
SMILESC=C1OC(C)CC1(C)C
InChIInChI=1S/C8H14O/c1-6-5-8(3,4)7(2)9-6/h6H,2,5H2,1,3-4H3
InChIKeyPYRZPJYRFOLQRQ-UHFFFAOYSA-N
MW126.20 g/mol
LogP2.34
Rot. Bonds

About 3,3,5-trimethyl-2-methylideneoxolane

3,3,5-trimethyl-2-methylideneoxolane (PubChem CID 67949108) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 3,3,5-trimethyl-2-methylideneoxolane.

Molecular Properties

Compound Name3,3,5-trimethyl-2-methylideneoxolane
PubChem CID67949108
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name3,3,5-trimethyl-2-methylideneoxolane
SMILESC=C1OC(C)CC1(C)C
InChIInChI=1S/C8H14O/c1-6-5-8(3,4)7(2)9-6/h6H,2,5H2,1,3-4H3
InChIKeyPYRZPJYRFOLQRQ-UHFFFAOYSA-N
XLogP2.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3,3,5-trimethyl-2-methylideneoxolane 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 3,3,5-trimethyl-2-methylideneoxolane?
The IUPAC name of 3,3,5-trimethyl-2-methylideneoxolane (CID 67949108) is 3,3,5-trimethyl-2-methylideneoxolane.
What is the SMILES notation for 3,3,5-trimethyl-2-methylideneoxolane?
The canonical SMILES for 3,3,5-trimethyl-2-methylideneoxolane is C=C1OC(C)CC1(C)C.
What is the InChIKey of 3,3,5-trimethyl-2-methylideneoxolane?
The InChIKey is PYRZPJYRFOLQRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-6-5-8(3,4)7(2)9-6/h6H,2,5H2,1,3-4H3.
What are the key properties of 3,3,5-trimethyl-2-methylideneoxolane?
3,3,5-trimethyl-2-methylideneoxolane has a molecular weight of 126.20 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5-trimethyl-2-methylideneoxolane is sourced from PubChem (CID 67949108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).