3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane

C11H24O2 — CID 123257231

IUPAC3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane
SMILESCCC(C)(CCOC(C)(C)C)OC
InChIInChI=1S/C11H24O2/c1-7-11(5,12-6)8-9-13-10(2,3)4/h7-9H2,1-6H3
InChIKeyHPQUODXWWCMNCM-UHFFFAOYSA-N
MW188.31 g/mol
LogP3.01
Rot. Bonds5

About 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane

3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane (PubChem CID 123257231) has the molecular formula C11H24O2 and a molecular weight of 188.31 g/mol. Its IUPAC name is 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane.

Molecular Properties

Compound Name3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane
PubChem CID123257231
Molecular FormulaC11H24O2
Molecular Weight188.31 g/mol
Exact Mass188.18
IUPAC Name3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane
SMILESCCC(C)(CCOC(C)(C)C)OC
InChIInChI=1S/C11H24O2/c1-7-11(5,12-6)8-9-13-10(2,3)4/h7-9H2,1-6H3
InChIKeyHPQUODXWWCMNCM-UHFFFAOYSA-N
XLogP3.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(3-methoxy-3-methylpentoxy)-6-methylheptane-2-thiol
CID 88986891
4-(1-methoxy-3-methylpentan-3-yl)oxy-2-methylbutan-2-amine
CID 142600828
2-[3-(3-methoxy-3-methylpentoxy)-3-methylpentoxy]ethyl methanesulfonate
CID 123590597
3,3-dimethyl-1-[(2-methylpropan-2-yl)oxy]butane
CID 546092
3-methoxy-3-methyldodecane
CID 150409844
2,2-diethyl-4-[(2-methylpropan-2-yl)oxy]butan-1-amine
CID 112591457
2-(3,3-dimethylbutoxy)-2-methylbutan-1-ol
CID 90988843
3,3-diethyl-6,6-dimethyl-1-[(2-methylpropan-2-yl)oxy]heptane
CID 89254911
N,2-dimethyl-2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]butan-1-amine
CID 112589696
N-ethyl-2,2-dimethyl-4-[(2-methylpropan-2-yl)oxy]butan-1-amine
CID 112591463
3-methyl-1-(3-methylpentan-3-yloxy)-3-(2-methylpropoxy)pentane
CID 89169879
1-methoxy-3-methyl-3-(3-methylpentoxy)pentane
CID 89083438

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane?
The IUPAC name of 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane (CID 123257231) is 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane.
What is the SMILES notation for 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane?
The canonical SMILES for 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane is CCC(C)(CCOC(C)(C)C)OC.
What is the InChIKey of 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane?
The InChIKey is HPQUODXWWCMNCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2/c1-7-11(5,12-6)8-9-13-10(2,3)4/h7-9H2,1-6H3.
What are the key properties of 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane?
3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane has a molecular weight of 188.31 g/mol, XLogP of 3.01, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-3-methyl-1-[(2-methylpropan-2-yl)oxy]pentane is sourced from PubChem (CID 123257231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).