ethane;3-ethyl-3-methylsulfanyloxetane

C8H18OS — CID 170732273

IUPACethane;3-ethyl-3-methylsulfanyloxetane
SMILESCC.CCC1(SC)COC1
InChIInChI=1S/C6H12OS.C2H6/c1-3-6(8-2)4-7-5-6;1-2/h3-5H2,1-2H3;1-2H3
InChIKeyYJNMKRAPHYYHQB-UHFFFAOYSA-N
MW162.30 g/mol
LogP2.55
Rot. Bonds2

About ethane;3-ethyl-3-methylsulfanyloxetane

ethane;3-ethyl-3-methylsulfanyloxetane (PubChem CID 170732273) has the molecular formula C8H18OS and a molecular weight of 162.30 g/mol. Its IUPAC name is ethane;3-ethyl-3-methylsulfanyloxetane.

Molecular Properties

Compound Nameethane;3-ethyl-3-methylsulfanyloxetane
PubChem CID170732273
Molecular FormulaC8H18OS
Molecular Weight162.30 g/mol
Exact Mass162.11
IUPAC Nameethane;3-ethyl-3-methylsulfanyloxetane
SMILESCC.CCC1(SC)COC1
InChIInChI=1S/C6H12OS.C2H6/c1-3-6(8-2)4-7-5-6;1-2/h3-5H2,1-2H3;1-2H3
InChIKeyYJNMKRAPHYYHQB-UHFFFAOYSA-N
XLogP2.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.30
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;3-ethyl-3-methylsulfanyloxetane 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

3-(2-Butoxyethyl)thietane
CID 117956676
3-Propan-2-yl-3-propan-2-ylsulfanyloxetane
CID 164846026
3-(Methoxymethyl)-3-propan-2-ylthietane
CID 167542491
3-Butylsulfanyl-1-methoxy-3-methylbutane
CID 86117668
3-Butan-2-ylsulfanyl-1-methoxy-3-methylbutane
CID 86117671
3-Tert-butylsulfanyl-1-methoxy-3-methylbutane
CID 86117675
1-Methoxy-3-methyl-3-methylsulfanylbutane
CID 102301237
3-Ethyl-3-methylsulfanyloxetane
CID 170732274

Frequently Asked Questions

What is the IUPAC name of ethane;3-ethyl-3-methylsulfanyloxetane?
The IUPAC name of ethane;3-ethyl-3-methylsulfanyloxetane (CID 170732273) is ethane;3-ethyl-3-methylsulfanyloxetane.
What is the SMILES notation for ethane;3-ethyl-3-methylsulfanyloxetane?
The canonical SMILES for ethane;3-ethyl-3-methylsulfanyloxetane is CC.CCC1(SC)COC1.
What is the InChIKey of ethane;3-ethyl-3-methylsulfanyloxetane?
The InChIKey is YJNMKRAPHYYHQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12OS.C2H6/c1-3-6(8-2)4-7-5-6;1-2/h3-5H2,1-2H3;1-2H3.
What are the key properties of ethane;3-ethyl-3-methylsulfanyloxetane?
ethane;3-ethyl-3-methylsulfanyloxetane has a molecular weight of 162.30 g/mol, XLogP of 2.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-ethyl-3-methylsulfanyloxetane is sourced from PubChem (CID 170732273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).