2,3-dimethyl-1,3-thiazolidine 1-oxide

C5H11NOS — CID 154470846

IUPAC2,3-dimethyl-1,3-thiazolidine 1-oxide
SMILESCC1N(C)CCS1=O
InChIInChI=1S/C5H11NOS/c1-5-6(2)3-4-8(5)7/h5H,3-4H2,1-2H3
InChIKeyGCAXQJJBQBHDJW-UHFFFAOYSA-N
MW133.22 g/mol
LogP0.03
Rot. Bonds

About 2,3-dimethyl-1,3-thiazolidine 1-oxide

2,3-dimethyl-1,3-thiazolidine 1-oxide (PubChem CID 154470846) has the molecular formula C5H11NOS and a molecular weight of 133.22 g/mol. Its IUPAC name is 2,3-dimethyl-1,3-thiazolidine 1-oxide.

Molecular Properties

Compound Name2,3-dimethyl-1,3-thiazolidine 1-oxide
PubChem CID154470846
Molecular FormulaC5H11NOS
Molecular Weight133.22 g/mol
Exact Mass133.06
IUPAC Name2,3-dimethyl-1,3-thiazolidine 1-oxide
SMILESCC1N(C)CCS1=O
InChIInChI=1S/C5H11NOS/c1-5-6(2)3-4-8(5)7/h5H,3-4H2,1-2H3
InChIKeyGCAXQJJBQBHDJW-UHFFFAOYSA-N
XLogP0.03
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.22
LogP ≤ 50.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Methyl-2-(trifluoromethyl)-1,3-thiazolidine 1-oxide
CID 145167741
2,3-Dimethyl-1,3-thiazolidine
CID 21740483
3-Methyl-1,3-thiazolidine 1,1-dioxide
CID 22967034
3-Ethyl-2-methyl-1,3-thiazolidine
CID 45087491
3-Methyl-1,3-thiazolidine 1-oxide
CID 58967535
3-Tert-butyl-1,3-thiazolidine 1-oxide
CID 59127286
2,2,3-Trimethyl-1,3-thiazolidine 1,1-dioxide
CID 68222574
3-Ethyl-1,3-thiazolidine 1-oxide
CID 88976067
3-Ethyl-1,3-thiazolidine 1,1-dioxide
CID 88984118
4-Methyl-3-propan-2-yl-1,3-thiazolidine 1-oxide
CID 89045410
(2S)-2,3-dimethyl-1,3-thiazolidine
CID 89094472
2-Ethyl-3-methyl-1,3-thiazolidine 1,1-dioxide
CID 89129328

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1,3-thiazolidine 1-oxide?
The IUPAC name of 2,3-dimethyl-1,3-thiazolidine 1-oxide (CID 154470846) is 2,3-dimethyl-1,3-thiazolidine 1-oxide.
What is the SMILES notation for 2,3-dimethyl-1,3-thiazolidine 1-oxide?
The canonical SMILES for 2,3-dimethyl-1,3-thiazolidine 1-oxide is CC1N(C)CCS1=O.
What is the InChIKey of 2,3-dimethyl-1,3-thiazolidine 1-oxide?
The InChIKey is GCAXQJJBQBHDJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NOS/c1-5-6(2)3-4-8(5)7/h5H,3-4H2,1-2H3.
What are the key properties of 2,3-dimethyl-1,3-thiazolidine 1-oxide?
2,3-dimethyl-1,3-thiazolidine 1-oxide has a molecular weight of 133.22 g/mol, XLogP of 0.03, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1,3-thiazolidine 1-oxide is sourced from PubChem (CID 154470846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).