2-methyl-5-methylidene-2-propan-2-yloxolane

C9H16O — CID 58618167

IUPAC2-methyl-5-methylidene-2-propan-2-yloxolane
SMILESC=C1CCC(C)(C(C)C)O1
InChIInChI=1S/C9H16O/c1-7(2)9(4)6-5-8(3)10-9/h7H,3,5-6H2,1-2,4H3
InChIKeyRBVNQDVHANNFHX-UHFFFAOYSA-N
MW140.23 g/mol
LogP2.73
Rot. Bonds1

About 2-methyl-5-methylidene-2-propan-2-yloxolane

2-methyl-5-methylidene-2-propan-2-yloxolane (PubChem CID 58618167) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is 2-methyl-5-methylidene-2-propan-2-yloxolane.

Molecular Properties

Compound Name2-methyl-5-methylidene-2-propan-2-yloxolane
PubChem CID58618167
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name2-methyl-5-methylidene-2-propan-2-yloxolane
SMILESC=C1CCC(C)(C(C)C)O1
InChIInChI=1S/C9H16O/c1-7(2)9(4)6-5-8(3)10-9/h7H,3,5-6H2,1-2,4H3
InChIKeyRBVNQDVHANNFHX-UHFFFAOYSA-N
XLogP2.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-methyl-5-methylidene-2-propan-2-yloxolane 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-5-methylidene-2-propan-2-yloxolane?
The IUPAC name of 2-methyl-5-methylidene-2-propan-2-yloxolane (CID 58618167) is 2-methyl-5-methylidene-2-propan-2-yloxolane.
What is the SMILES notation for 2-methyl-5-methylidene-2-propan-2-yloxolane?
The canonical SMILES for 2-methyl-5-methylidene-2-propan-2-yloxolane is C=C1CCC(C)(C(C)C)O1.
What is the InChIKey of 2-methyl-5-methylidene-2-propan-2-yloxolane?
The InChIKey is RBVNQDVHANNFHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16O/c1-7(2)9(4)6-5-8(3)10-9/h7H,3,5-6H2,1-2,4H3.
What are the key properties of 2-methyl-5-methylidene-2-propan-2-yloxolane?
2-methyl-5-methylidene-2-propan-2-yloxolane has a molecular weight of 140.23 g/mol, XLogP of 2.73, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-methylidene-2-propan-2-yloxolane is sourced from PubChem (CID 58618167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).