3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane

C16H34O2 — CID 89169879

IUPAC3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane
SMILESCCC(C)(CC)OCCC(C)(CC)OCC(C)C
InChIInChI=1S/C16H34O2/c1-8-15(6,9-2)17-12-11-16(7,10-3)18-13-14(4)5/h14H,8-13H2,1-7H3
InChIKeyWUEAIGRIKMGNLD-UHFFFAOYSA-N
MW258.45 g/mol
LogP4.81
Rot. Bonds10

About 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane

3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane (PubChem CID 89169879) has the molecular formula C16H34O2 and a molecular weight of 258.45 g/mol. Its IUPAC name is 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane.

Molecular Properties

Compound Name3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane
PubChem CID89169879
Molecular FormulaC16H34O2
Molecular Weight258.45 g/mol
Exact Mass258.26
IUPAC Name3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane
SMILESCCC(C)(CC)OCCC(C)(CC)OCC(C)C
InChIInChI=1S/C16H34O2/c1-8-15(6,9-2)17-12-11-16(7,10-3)18-13-14(4)5/h14H,8-13H2,1-7H3
InChIKeyWUEAIGRIKMGNLD-UHFFFAOYSA-N
XLogP4.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.45
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane 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 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane?
The IUPAC name of 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane (CID 89169879) is 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane.
What is the SMILES notation for 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane?
The canonical SMILES for 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane is CCC(C)(CC)OCCC(C)(CC)OCC(C)C.
What is the InChIKey of 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane?
The InChIKey is WUEAIGRIKMGNLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2/c1-8-15(6,9-2)17-12-11-16(7,10-3)18-13-14(4)5/h14H,8-13H2,1-7H3.
What are the key properties of 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane?
3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane has a molecular weight of 258.45 g/mol, XLogP of 4.81, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane is sourced from PubChem (CID 89169879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).