2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane

C19H34O5 — CID 70943605

IUPAC2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane
SMILESCCC1(C)CC(C2COC(C)(CC)O2)C(C2COC(C)(CC)O2)O1
InChIInChI=1S/C19H34O5/c1-7-17(4)10-13(14-11-20-18(5,8-2)22-14)16(24-17)15-12-21-19(6,9-3)23-15/h13-16H,7-12H2,1-6H3
InChIKeyDBBHDAYJIHNBJP-UHFFFAOYSA-N
MW342.48 g/mol
LogP3.64
Rot. Bonds5

About 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane

2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane (PubChem CID 70943605) has the molecular formula C19H34O5 and a molecular weight of 342.48 g/mol. Its IUPAC name is 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane.

Molecular Properties

Compound Name2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane
PubChem CID70943605
Molecular FormulaC19H34O5
Molecular Weight342.48 g/mol
Exact Mass342.24
IUPAC Name2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane
SMILESCCC1(C)CC(C2COC(C)(CC)O2)C(C2COC(C)(CC)O2)O1
InChIInChI=1S/C19H34O5/c1-7-17(4)10-13(14-11-20-18(5,8-2)22-14)16(24-17)15-12-21-19(6,9-3)23-15/h13-16H,7-12H2,1-6H3
InChIKeyDBBHDAYJIHNBJP-UHFFFAOYSA-N
XLogP3.64
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.48
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane 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-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane?
The IUPAC name of 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane (CID 70943605) is 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane.
What is the SMILES notation for 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane?
The canonical SMILES for 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane is CCC1(C)CC(C2COC(C)(CC)O2)C(C2COC(C)(CC)O2)O1.
What is the InChIKey of 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane?
The InChIKey is DBBHDAYJIHNBJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34O5/c1-7-17(4)10-13(14-11-20-18(5,8-2)22-14)16(24-17)15-12-21-19(6,9-3)23-15/h13-16H,7-12H2,1-6H3.
What are the key properties of 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane?
2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane has a molecular weight of 342.48 g/mol, XLogP of 3.64, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-[5-ethyl-2-(2-ethyl-2-methyl-1,3-dioxolan-4-yl)-5-methyloxolan-3-yl]-2-methyl-1,3-dioxolane is sourced from PubChem (CID 70943605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).