1-methoxy-2-methylsulfinylethane;methylcyclopropane

C8H18O2S — CID 160771921

IUPAC1-methoxy-2-methylsulfinylethane;methylcyclopropane
SMILESCC1CC1.COCCS(C)=O
InChIInChI=1S/C4H10O2S.C4H8/c1-6-3-4-7(2)5;1-4-2-3-4/h3-4H2,1-2H3;4H,2-3H2,1H3
InChIKeyRZKUOWATXVWYLH-UHFFFAOYSA-N
MW178.30 g/mol
LogP1.43
Rot. Bonds3

About 1-methoxy-2-methylsulfinylethane;methylcyclopropane

1-methoxy-2-methylsulfinylethane;methylcyclopropane (PubChem CID 160771921) has the molecular formula C8H18O2S and a molecular weight of 178.30 g/mol. Its IUPAC name is 1-methoxy-2-methylsulfinylethane;methylcyclopropane.

Molecular Properties

Compound Name1-methoxy-2-methylsulfinylethane;methylcyclopropane
PubChem CID160771921
Molecular FormulaC8H18O2S
Molecular Weight178.30 g/mol
Exact Mass178.10
IUPAC Name1-methoxy-2-methylsulfinylethane;methylcyclopropane
SMILESCC1CC1.COCCS(C)=O
InChIInChI=1S/C4H10O2S.C4H8/c1-6-3-4-7(2)5;1-4-2-3-4/h3-4H2,1-2H3;4H,2-3H2,1H3
InChIKeyRZKUOWATXVWYLH-UHFFFAOYSA-N
XLogP1.43
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.30
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-methoxy-2-methylsulfinylethane;methylcyclopropane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-methylsulfinylethane;methylcyclopropane?
The IUPAC name of 1-methoxy-2-methylsulfinylethane;methylcyclopropane (CID 160771921) is 1-methoxy-2-methylsulfinylethane;methylcyclopropane.
What is the SMILES notation for 1-methoxy-2-methylsulfinylethane;methylcyclopropane?
The canonical SMILES for 1-methoxy-2-methylsulfinylethane;methylcyclopropane is CC1CC1.COCCS(C)=O.
What is the InChIKey of 1-methoxy-2-methylsulfinylethane;methylcyclopropane?
The InChIKey is RZKUOWATXVWYLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O2S.C4H8/c1-6-3-4-7(2)5;1-4-2-3-4/h3-4H2,1-2H3;4H,2-3H2,1H3.
What are the key properties of 1-methoxy-2-methylsulfinylethane;methylcyclopropane?
1-methoxy-2-methylsulfinylethane;methylcyclopropane has a molecular weight of 178.30 g/mol, XLogP of 1.43, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-methylsulfinylethane;methylcyclopropane is sourced from PubChem (CID 160771921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).