2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane

C11H26O — CID 87276349

IUPAC2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane
SMILESCC(C)(C)OC(C)(C)C.CCC
InChIInChI=1S/C8H18O.C3H8/c1-7(2,3)9-8(4,5)6;1-3-2/h1-6H3;3H2,1-2H3
InChIKeyZJYZIYCLUADVIA-UHFFFAOYSA-N
MW174.33 g/mol
LogP4.02
Rot. Bonds

About 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane

2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane (PubChem CID 87276349) has the molecular formula C11H26O and a molecular weight of 174.33 g/mol. Its IUPAC name is 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane.

Molecular Properties

Compound Name2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane
PubChem CID87276349
Molecular FormulaC11H26O
Molecular Weight174.33 g/mol
Exact Mass174.20
IUPAC Name2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane
SMILESCC(C)(C)OC(C)(C)C.CCC
InChIInChI=1S/C8H18O.C3H8/c1-7(2,3)9-8(4,5)6;1-3-2/h1-6H3;3H2,1-2H3
InChIKeyZJYZIYCLUADVIA-UHFFFAOYSA-N
XLogP4.02
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.33
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane?
The IUPAC name of 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane (CID 87276349) is 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane.
What is the SMILES notation for 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane?
The canonical SMILES for 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane is CC(C)(C)OC(C)(C)C.CCC.
What is the InChIKey of 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane?
The InChIKey is ZJYZIYCLUADVIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O.C3H8/c1-7(2,3)9-8(4,5)6;1-3-2/h1-6H3;3H2,1-2H3.
What are the key properties of 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane?
2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane has a molecular weight of 174.33 g/mol, XLogP of 4.02, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[(2-methylpropan-2-yl)oxy]propane;propane is sourced from PubChem (CID 87276349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).