2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine

C7H10N2O3S2 — CID 104600574

IUPAC2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine
SMILESCc1ncc(S(=O)(=O)N2CCCO2)s1
InChIInChI=1S/C7H10N2O3S2/c1-6-8-5-7(13-6)14(10,11)9-3-2-4-12-9/h5H,2-4H2,1H3
InChIKeyJLJAOCUFRFTKCK-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.78
Rot. Bonds2

About 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine

2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine (PubChem CID 104600574) has the molecular formula C7H10N2O3S2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine.

Molecular Properties

Compound Name2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine
PubChem CID104600574
Molecular FormulaC7H10N2O3S2
Molecular Weight234.30 g/mol
Exact Mass234.01
IUPAC Name2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine
SMILESCc1ncc(S(=O)(=O)N2CCCO2)s1
InChIInChI=1S/C7H10N2O3S2/c1-6-8-5-7(13-6)14(10,11)9-3-2-4-12-9/h5H,2-4H2,1H3
InChIKeyJLJAOCUFRFTKCK-UHFFFAOYSA-N
XLogP0.78
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyclobutyl-4-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]morpholine
CID 128777456
7-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,4-dioxa-7-azaspiro[4.4]nonane
CID 131020159
(3R,4S)-1-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]pyrrolidine-3,4-diol
CID 104600170
(2S)-1-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]piperidine-2-carboxylic acid
CID 104937088
1-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]piperidin-3-ol
CID 103847906
5-(3-chloropyrrolidin-1-yl)sulfonyl-2-methyl-1,3-thiazole
CID 103415890
1-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]piperidine-4-carboxylic acid
CID 103862581
methyl (2R)-1-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]piperidine-2-carboxylate
CID 103847980
2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]pyrrolidin-2-yl]cyclopentan-1-one
CID 103414732
2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]piperidin-2-yl]cyclopentan-1-one
CID 103414737
5-(2-isocyanatopyrrolidin-1-yl)sulfonyl-2-methyl-1,3-thiazole
CID 103414770
8-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-8-azabicyclo[3.2.1]octan-3-ol
CID 103847919

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine?
The IUPAC name of 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine (CID 104600574) is 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine.
What is the SMILES notation for 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine?
The canonical SMILES for 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine is Cc1ncc(S(=O)(=O)N2CCCO2)s1.
What is the InChIKey of 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine?
The InChIKey is JLJAOCUFRFTKCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3S2/c1-6-8-5-7(13-6)14(10,11)9-3-2-4-12-9/h5H,2-4H2,1H3.
What are the key properties of 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine?
2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine has a molecular weight of 234.30 g/mol, XLogP of 0.78, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methyl-1,3-thiazol-5-yl)sulfonyl]-1,2-oxazolidine is sourced from PubChem (CID 104600574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).