2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane

C16H34O4 — CID 58121620

IUPAC2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane
SMILESCC(C)COC(C)COCCOCC(C)OCC(C)C
InChIInChI=1S/C16H34O4/c1-13(2)9-19-15(5)11-17-7-8-18-12-16(6)20-10-14(3)4/h13-16H,7-12H2,1-6H3
InChIKeyJTJWBWIYRWNJJH-UHFFFAOYSA-N
MW290.44 g/mol
LogP3.14
Rot. Bonds13

About 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane

2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane (PubChem CID 58121620) has the molecular formula C16H34O4 and a molecular weight of 290.44 g/mol. Its IUPAC name is 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane.

Molecular Properties

Compound Name2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane
PubChem CID58121620
Molecular FormulaC16H34O4
Molecular Weight290.44 g/mol
Exact Mass290.25
IUPAC Name2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane
SMILESCC(C)COC(C)COCCOCC(C)OCC(C)C
InChIInChI=1S/C16H34O4/c1-13(2)9-19-15(5)11-17-7-8-18-12-16(6)20-10-14(3)4/h13-16H,7-12H2,1-6H3
InChIKeyJTJWBWIYRWNJJH-UHFFFAOYSA-N
XLogP3.14
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.44
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]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-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane?
The IUPAC name of 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane (CID 58121620) is 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane.
What is the SMILES notation for 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane?
The canonical SMILES for 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane is CC(C)COC(C)COCCOCC(C)OCC(C)C.
What is the InChIKey of 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane?
The InChIKey is JTJWBWIYRWNJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O4/c1-13(2)9-19-15(5)11-17-7-8-18-12-16(6)20-10-14(3)4/h13-16H,7-12H2,1-6H3.
What are the key properties of 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane?
2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane has a molecular weight of 290.44 g/mol, XLogP of 3.14, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[1-[2-[2-(2-methylpropoxy)propoxy]ethoxy]propan-2-yloxy]propane is sourced from PubChem (CID 58121620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).