2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane

C16H34O — CID 57285843

IUPAC2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane
SMILESCCC(C)(C)C(C)(C)OC(C)(C)C(C)(C)CC
InChIInChI=1S/C16H34O/c1-11-13(3,4)15(7,8)17-16(9,10)14(5,6)12-2/h11-12H2,1-10H3
InChIKeyGMGYAGFUBFTLRJ-UHFFFAOYSA-N
MW242.45 g/mol
LogP5.43
Rot. Bonds6

About 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane

2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane (PubChem CID 57285843) has the molecular formula C16H34O and a molecular weight of 242.45 g/mol. Its IUPAC name is 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane.

Molecular Properties

Compound Name2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane
PubChem CID57285843
Molecular FormulaC16H34O
Molecular Weight242.45 g/mol
Exact Mass242.26
IUPAC Name2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane
SMILESCCC(C)(C)C(C)(C)OC(C)(C)C(C)(C)CC
InChIInChI=1S/C16H34O/c1-11-13(3,4)15(7,8)17-16(9,10)14(5,6)12-2/h11-12H2,1-10H3
InChIKeyGMGYAGFUBFTLRJ-UHFFFAOYSA-N
XLogP5.43
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.45
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane?
The IUPAC name of 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane (CID 57285843) is 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane.
What is the SMILES notation for 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane?
The canonical SMILES for 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane is CCC(C)(C)C(C)(C)OC(C)(C)C(C)(C)CC.
What is the InChIKey of 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane?
The InChIKey is GMGYAGFUBFTLRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34O/c1-11-13(3,4)15(7,8)17-16(9,10)14(5,6)12-2/h11-12H2,1-10H3.
What are the key properties of 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane?
2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane has a molecular weight of 242.45 g/mol, XLogP of 5.43, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3-trimethyl-2-(2,3,3-trimethylpentan-2-yloxy)pentane is sourced from PubChem (CID 57285843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).