2-methyl-1-[1-(2-methylpropoxy)propoxy]propane

C11H24O2 — CID 19963983

IUPAC2-methyl-1-[1-(2-methylpropoxy)propoxy]propane
SMILESCCC(OCC(C)C)OCC(C)C
InChIInChI=1S/C11H24O2/c1-6-11(12-7-9(2)3)13-8-10(4)5/h9-11H,6-8H2,1-5H3
InChIKeyUSYFLBOYMYXIBN-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.07
Rot. Bonds7

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

2-methyl-1-[1-(2-methylpropoxy)propoxy]propane (PubChem CID 19963983) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 2-methyl-1-[1-(2-methylpropoxy)propoxy]propane.

Molecular Properties

Compound Name2-methyl-1-[1-(2-methylpropoxy)propoxy]propane
PubChem CID19963983
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name2-methyl-1-[1-(2-methylpropoxy)propoxy]propane
SMILESCCC(OCC(C)C)OCC(C)C
InChIInChI=1S/C11H24O2/c1-6-11(12-7-9(2)3)13-8-10(4)5/h9-11H,6-8H2,1-5H3
InChIKeyUSYFLBOYMYXIBN-UHFFFAOYSA-N
XLogP3.07
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[1-(2-methylpropoxy)propoxy]propane?
The IUPAC name of 2-methyl-1-[1-(2-methylpropoxy)propoxy]propane (CID 19963983) is 2-methyl-1-[1-(2-methylpropoxy)propoxy]propane.
What is the SMILES notation for 2-methyl-1-[1-(2-methylpropoxy)propoxy]propane?
The canonical SMILES for 2-methyl-1-[1-(2-methylpropoxy)propoxy]propane is CCC(OCC(C)C)OCC(C)C.
What is the InChIKey of 2-methyl-1-[1-(2-methylpropoxy)propoxy]propane?
The InChIKey is USYFLBOYMYXIBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2/c1-6-11(12-7-9(2)3)13-8-10(4)5/h9-11H,6-8H2,1-5H3.
What are the key properties of 2-methyl-1-[1-(2-methylpropoxy)propoxy]propane?
2-methyl-1-[1-(2-methylpropoxy)propoxy]propane has a molecular weight of 188.31 g/mol, XLogP of 3.07, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[1-(2-methylpropoxy)propoxy]propane is sourced from PubChem (CID 19963983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).