2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane

C16H34O2 — CID 88849397

IUPAC2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane
SMILESCCC(C)(CC(C)C)OC(C)(C)COC(C)(C)C
InChIInChI=1S/C16H34O2/c1-10-16(9,11-13(2)3)18-15(7,8)12-17-14(4,5)6/h13H,10-12H2,1-9H3
InChIKeyHUSDXVYGJRZSFG-UHFFFAOYSA-N
MW258.45 g/mol
LogP4.81
Rot. Bonds7

About 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane

2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane (PubChem CID 88849397) has the molecular formula C16H34O2 and a molecular weight of 258.45 g/mol. Its IUPAC name is 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane.

Molecular Properties

Compound Name2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane
PubChem CID88849397
Molecular FormulaC16H34O2
Molecular Weight258.45 g/mol
Exact Mass258.26
IUPAC Name2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane
SMILESCCC(C)(CC(C)C)OC(C)(C)COC(C)(C)C
InChIInChI=1S/C16H34O2/c1-10-16(9,11-13(2)3)18-15(7,8)12-17-14(4,5)6/h13H,10-12H2,1-9H3
InChIKeyHUSDXVYGJRZSFG-UHFFFAOYSA-N
XLogP4.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
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 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane 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 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane?
The IUPAC name of 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane (CID 88849397) is 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane.
What is the SMILES notation for 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane?
The canonical SMILES for 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane is CCC(C)(CC(C)C)OC(C)(C)COC(C)(C)C.
What is the InChIKey of 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane?
The InChIKey is HUSDXVYGJRZSFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O2/c1-10-16(9,11-13(2)3)18-15(7,8)12-17-14(4,5)6/h13H,10-12H2,1-9H3.
What are the key properties of 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane?
2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane has a molecular weight of 258.45 g/mol, XLogP of 4.81, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-4-[2-methyl-1-[(2-methylpropan-2-yl)oxy]propan-2-yl]oxyhexane is sourced from PubChem (CID 88849397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).