2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane

C10H20O3 — CID 22491590

IUPAC2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane
SMILESC=COC(C)(COC(C)C)OCC
InChIInChI=1S/C10H20O3/c1-6-12-10(5,13-7-2)8-11-9(3)4/h6,9H,1,7-8H2,2-5H3
InChIKeyFZIOVNGUTJGUNM-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.32
Rot. Bonds7

About 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane

2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane (PubChem CID 22491590) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane.

Molecular Properties

Compound Name2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane
PubChem CID22491590
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane
SMILESC=COC(C)(COC(C)C)OCC
InChIInChI=1S/C10H20O3/c1-6-12-10(5,13-7-2)8-11-9(3)4/h6,9H,1,7-8H2,2-5H3
InChIKeyFZIOVNGUTJGUNM-UHFFFAOYSA-N
XLogP2.32
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane 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-ethenoxy-2-ethoxy-1-propan-2-yloxypropane?
The IUPAC name of 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane (CID 22491590) is 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane.
What is the SMILES notation for 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane?
The canonical SMILES for 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane is C=COC(C)(COC(C)C)OCC.
What is the InChIKey of 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane?
The InChIKey is FZIOVNGUTJGUNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-6-12-10(5,13-7-2)8-11-9(3)4/h6,9H,1,7-8H2,2-5H3.
What are the key properties of 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane?
2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane has a molecular weight of 188.27 g/mol, XLogP of 2.32, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenoxy-2-ethoxy-1-propan-2-yloxypropane is sourced from PubChem (CID 22491590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).