2-ethoxy-2-methylundecane

C14H30O — CID 150956805

IUPAC2-ethoxy-2-methylundecane
SMILESCCCCCCCCCC(C)(C)OCC
InChIInChI=1S/C14H30O/c1-5-7-8-9-10-11-12-13-14(3,4)15-6-2/h5-13H2,1-4H3
InChIKeyLLGHYVXTTIEZPZ-UHFFFAOYSA-N
MW214.39 g/mol
LogP4.94
Rot. Bonds10

About 2-ethoxy-2-methylundecane

2-ethoxy-2-methylundecane (PubChem CID 150956805) has the molecular formula C14H30O and a molecular weight of 214.39 g/mol. Its IUPAC name is 2-ethoxy-2-methylundecane.

Molecular Properties

Compound Name2-ethoxy-2-methylundecane
PubChem CID150956805
Molecular FormulaC14H30O
Molecular Weight214.39 g/mol
Exact Mass214.23
IUPAC Name2-ethoxy-2-methylundecane
SMILESCCCCCCCCCC(C)(C)OCC
InChIInChI=1S/C14H30O/c1-5-7-8-9-10-11-12-13-14(3,4)15-6-2/h5-13H2,1-4H3
InChIKeyLLGHYVXTTIEZPZ-UHFFFAOYSA-N
XLogP4.94
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.39
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-ethoxy-2-methylundecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-dodecoxy-2-methyltetradecane
CID 158074564
2-methylicosan-2-yloxysilane
CID 173002328
2,2-diethoxynonane
CID 89439020
ruthenium;1,1,1-triethoxydecane
CID 157324278
2-ethoxytetradecan-2-ol
CID 154401470
2-hydroperoxy-2-methyltridecane
CID 140639786
2-hydroperoxy-2-methylnonane
CID 15188455
12-ethoxy-2,12-dimethyltridecan-1-amine
CID 150200796
2-[2-(2-methyloctan-2-yloxy)ethoxy]ethanol
CID 142712379
2-methyl-2-propoxyhexane
CID 91043348
3-ethoxy-3-methyldodec-1-ene
CID 160659750
7-butoxy-1-chloro-7-methyloctane
CID 166130931

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-methylundecane?
The IUPAC name of 2-ethoxy-2-methylundecane (CID 150956805) is 2-ethoxy-2-methylundecane.
What is the SMILES notation for 2-ethoxy-2-methylundecane?
The canonical SMILES for 2-ethoxy-2-methylundecane is CCCCCCCCCC(C)(C)OCC.
What is the InChIKey of 2-ethoxy-2-methylundecane?
The InChIKey is LLGHYVXTTIEZPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O/c1-5-7-8-9-10-11-12-13-14(3,4)15-6-2/h5-13H2,1-4H3.
What are the key properties of 2-ethoxy-2-methylundecane?
2-ethoxy-2-methylundecane has a molecular weight of 214.39 g/mol, XLogP of 4.94, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-methylundecane is sourced from PubChem (CID 150956805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).