2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane

C10H20O3 — CID 90736811

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

About 2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane

2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane (PubChem CID 90736811) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane.

Molecular Properties

Compound Name2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane
PubChem CID90736811
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane
SMILESC=COC(COC(C)C)OC(C)C
InChIInChI=1S/C10H20O3/c1-6-11-10(13-9(4)5)7-12-8(2)3/h6,8-10H,1,7H2,2-5H3
InChIKeyMMMNUVPMGPSGNZ-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-(2-ethenoxy-2-propan-2-yloxyethoxy)propane 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-(2-ethenoxy-2-propan-2-yloxyethoxy)propane?
The IUPAC name of 2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane (CID 90736811) is 2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane.
What is the SMILES notation for 2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane?
The canonical SMILES for 2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane is C=COC(COC(C)C)OC(C)C.
What is the InChIKey of 2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane?
The InChIKey is MMMNUVPMGPSGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-6-11-10(13-9(4)5)7-12-8(2)3/h6,8-10H,1,7H2,2-5H3.
What are the key properties of 2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane?
2-(2-ethenoxy-2-propan-2-yloxyethoxy)propane 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-(2-ethenoxy-2-propan-2-yloxyethoxy)propane is sourced from PubChem (CID 90736811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).