2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane

C9H20O2S — CID 134353103

IUPAC2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane
SMILESCOCCOCCSC(C)(C)C
InChIInChI=1S/C9H20O2S/c1-9(2,3)12-8-7-11-6-5-10-4/h5-8H2,1-4H3
InChIKeyZIFRBFJFBNNOFO-UHFFFAOYSA-N
MW192.32 g/mol
LogP2.18
Rot. Bonds6

About 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane

2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane (PubChem CID 134353103) has the molecular formula C9H20O2S and a molecular weight of 192.32 g/mol. Its IUPAC name is 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane.

Molecular Properties

Compound Name2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane
PubChem CID134353103
Molecular FormulaC9H20O2S
Molecular Weight192.32 g/mol
Exact Mass192.12
IUPAC Name2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane
SMILESCOCCOCCSC(C)(C)C
InChIInChI=1S/C9H20O2S/c1-9(2,3)12-8-7-11-6-5-10-4/h5-8H2,1-4H3
InChIKeyZIFRBFJFBNNOFO-UHFFFAOYSA-N
XLogP2.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.32
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane 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-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropanoic acid
CID 81229569
2-(2-tert-butylsulfanylethoxy)ethanamine
CID 103482631
2-(2-tert-butylsulfanylethoxy)ethanol
CID 10932017
1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyldisulfanyl]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethane
CID 102414986
1-(2-tert-butylsulfanylethoxy)-4,4-dimethylpentane
CID 155109854
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
1,2-dimethoxyethane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 159847962
CID 173303266
CID 173303266
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium
CID 161321430
lithium bis(1-methoxy-2-(2-methoxyethoxy)ethane)
CID 5257331
CID 172826348
CID 172826348

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane?
The IUPAC name of 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane (CID 134353103) is 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane.
What is the SMILES notation for 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane?
The canonical SMILES for 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane is COCCOCCSC(C)(C)C.
What is the InChIKey of 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane?
The InChIKey is ZIFRBFJFBNNOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2S/c1-9(2,3)12-8-7-11-6-5-10-4/h5-8H2,1-4H3.
What are the key properties of 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane?
2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane has a molecular weight of 192.32 g/mol, XLogP of 2.18, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyethoxy)ethylsulfanyl]-2-methylpropane is sourced from PubChem (CID 134353103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).