2-methyl-1,2-thiazolidine 1,1-dioxide

C4H9NO2S — CID 15577564

IUPAC2-methyl-1,2-thiazolidine 1,1-dioxide
SMILESCN1CCCS1(=O)=O
InChIInChI=1S/C4H9NO2S/c1-5-3-2-4-8(5,6)7/h2-4H2,1H3
InChIKeyGGUJLVPQFOPIJU-UHFFFAOYSA-N
MW135.19 g/mol
LogP-0.35
Rot. Bonds

About 2-methyl-1,2-thiazolidine 1,1-dioxide

2-methyl-1,2-thiazolidine 1,1-dioxide (PubChem CID 15577564) has the molecular formula C4H9NO2S and a molecular weight of 135.19 g/mol. Its IUPAC name is 2-methyl-1,2-thiazolidine 1,1-dioxide.

Molecular Properties

Compound Name2-methyl-1,2-thiazolidine 1,1-dioxide
PubChem CID15577564
Molecular FormulaC4H9NO2S
Molecular Weight135.19 g/mol
Exact Mass135.04
IUPAC Name2-methyl-1,2-thiazolidine 1,1-dioxide
SMILESCN1CCCS1(=O)=O
InChIInChI=1S/C4H9NO2S/c1-5-3-2-4-8(5,6)7/h2-4H2,1H3
InChIKeyGGUJLVPQFOPIJU-UHFFFAOYSA-N
XLogP-0.35
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.19
LogP ≤ 5-0.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(Trimethylammonio)propane-1-sulfonate
CID 30837
1-Methanesulfonylpyrrolidine
CID 3812935
1-Propylsulfonylpyrrolidine
CID 303057
1-Butylsulfonylpyrrolidine
CID 303063
2-Prop-2-ynyl-1,2-thiazolidine 1,1-dioxide
CID 61343040
(3R)-3-fluoro-1-propan-2-ylsulfonylpyrrolidine
CID 124082859
3-Fluoro-1-propan-2-ylsulfonylpyrrolidine
CID 131966897
(3S)-3-fluoro-1-propan-2-ylsulfonylpyrrolidine
CID 134590493
1-Ethylsulfonyl-3-fluoropyrrolidine
CID 145194176
(3S)-1-ethylsulfonyl-3-fluoropyrrolidine
CID 145194184
1-Pentylsulfonylpyrrolidine
CID 303120
1,1-Dioxo-1,2-thiazolidine-2-carbonitrile
CID 117029846

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,2-thiazolidine 1,1-dioxide?
The IUPAC name of 2-methyl-1,2-thiazolidine 1,1-dioxide (CID 15577564) is 2-methyl-1,2-thiazolidine 1,1-dioxide.
What is the SMILES notation for 2-methyl-1,2-thiazolidine 1,1-dioxide?
The canonical SMILES for 2-methyl-1,2-thiazolidine 1,1-dioxide is CN1CCCS1(=O)=O.
What is the InChIKey of 2-methyl-1,2-thiazolidine 1,1-dioxide?
The InChIKey is GGUJLVPQFOPIJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2S/c1-5-3-2-4-8(5,6)7/h2-4H2,1H3.
What are the key properties of 2-methyl-1,2-thiazolidine 1,1-dioxide?
2-methyl-1,2-thiazolidine 1,1-dioxide has a molecular weight of 135.19 g/mol, XLogP of -0.35, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,2-thiazolidine 1,1-dioxide is sourced from PubChem (CID 15577564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).