2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane

C11H24O3 — CID 87735391

IUPAC2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane
SMILESCCCOCCOCCOC(C)(C)C
InChIInChI=1S/C11H24O3/c1-5-6-12-7-8-13-9-10-14-11(2,3)4/h5-10H2,1-4H3
InChIKeyPXFXYAHDEWSPMC-UHFFFAOYSA-N
MW204.31 g/mol
LogP2.24
Rot. Bonds8

About 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane

2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane (PubChem CID 87735391) has the molecular formula C11H24O3 and a molecular weight of 204.31 g/mol. Its IUPAC name is 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane.

Molecular Properties

Compound Name2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane
PubChem CID87735391
Molecular FormulaC11H24O3
Molecular Weight204.31 g/mol
Exact Mass204.17
IUPAC Name2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane
SMILESCCCOCCOCCOC(C)(C)C
InChIInChI=1S/C11H24O3/c1-5-6-12-7-8-13-9-10-14-11(2,3)4/h5-10H2,1-4H3
InChIKeyPXFXYAHDEWSPMC-UHFFFAOYSA-N
XLogP2.24
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane?
The IUPAC name of 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane (CID 87735391) is 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane.
What is the SMILES notation for 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane?
The canonical SMILES for 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane is CCCOCCOCCOC(C)(C)C.
What is the InChIKey of 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane?
The InChIKey is PXFXYAHDEWSPMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3/c1-5-6-12-7-8-13-9-10-14-11(2,3)4/h5-10H2,1-4H3.
What are the key properties of 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane?
2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane has a molecular weight of 204.31 g/mol, XLogP of 2.24, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[2-(2-propoxyethoxy)ethoxy]propane is sourced from PubChem (CID 87735391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).