2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane

C14H30O — CID 19786075

IUPAC2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane
SMILESCCC(C)C(C)(C)OC(C)(C)C(C)CC
InChIInChI=1S/C14H30O/c1-9-11(3)13(5,6)15-14(7,8)12(4)10-2/h11-12H,9-10H2,1-8H3
InChIKeyOTDNJTIXNJSXMR-UHFFFAOYSA-N
MW214.39 g/mol
LogP4.65
Rot. Bonds6

About 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane

2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane (PubChem CID 19786075) has the molecular formula C14H30O and a molecular weight of 214.39 g/mol. Its IUPAC name is 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane.

Molecular Properties

Compound Name2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane
PubChem CID19786075
Molecular FormulaC14H30O
Molecular Weight214.39 g/mol
Exact Mass214.23
IUPAC Name2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane
SMILESCCC(C)C(C)(C)OC(C)(C)C(C)CC
InChIInChI=1S/C14H30O/c1-9-11(3)13(5,6)15-14(7,8)12(4)10-2/h11-12H,9-10H2,1-8H3
InChIKeyOTDNJTIXNJSXMR-UHFFFAOYSA-N
XLogP4.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.39
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane?
The IUPAC name of 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane (CID 19786075) is 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane.
What is the SMILES notation for 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane?
The canonical SMILES for 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane is CCC(C)C(C)(C)OC(C)(C)C(C)CC.
What is the InChIKey of 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane?
The InChIKey is OTDNJTIXNJSXMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O/c1-9-11(3)13(5,6)15-14(7,8)12(4)10-2/h11-12H,9-10H2,1-8H3.
What are the key properties of 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane?
2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane has a molecular weight of 214.39 g/mol, XLogP of 4.65, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylpentan-2-yloxy)-2,3-dimethylpentane is sourced from PubChem (CID 19786075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).