6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide

C8H10F3N5O2S2 — CID 60890457

IUPAC6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCN(CC(F)(F)F)S(=O)(=O)c1c(NN)nc2sccn12
InChIInChI=1S/C8H10F3N5O2S2/c1-15(4-8(9,10)11)20(17,18)6-5(14-12)13-7-16(6)2-3-19-7/h2-3,14H,4,12H2,1H3
InChIKeyGZCQGWXYFMKBOF-UHFFFAOYSA-N
MW329.33 g/mol
LogP0.86
Rot. Bonds4

About 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide

6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 60890457) has the molecular formula C8H10F3N5O2S2 and a molecular weight of 329.33 g/mol. Its IUPAC name is 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound Name6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID60890457
Molecular FormulaC8H10F3N5O2S2
Molecular Weight329.33 g/mol
Exact Mass329.02
IUPAC Name6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCN(CC(F)(F)F)S(=O)(=O)c1c(NN)nc2sccn12
InChIInChI=1S/C8H10F3N5O2S2/c1-15(4-8(9,10)11)20(17,18)6-5(14-12)13-7-16(6)2-3-19-7/h2-3,14H,4,12H2,1H3
InChIKeyGZCQGWXYFMKBOF-UHFFFAOYSA-N
XLogP0.86
TPSA92.73 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.33
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-6-(methylamino)-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62148135
N-cyclohexyl-6-hydrazinyl-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 60814489
N-butyl-6-hydrazinyl-N-(2-hydroxyethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 61447495
N-ethyl-6-(ethylamino)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 55043775
N-(2,2-difluoroethyl)-6-hydrazinyl-N-(2-hydroxyethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 107480742
N-butyl-N-methyl-6-(methylamino)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62162472
N,N-dimethyl-6-(methylamino)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62149455
2-[(6-hydrazinylimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]acetamide
CID 60813647
N-methyl-6-(methylamino)-N-[(2-methylcyclopropyl)methyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 63859228
N-(2-hydroxyethyl)-N-methyl-6-(propylamino)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62146195
6-hydrazinyl-N-(2-sulfamoylethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 60812992
N-[2-[(6-hydrazinylimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]ethyl]acetamide
CID 60812994

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 60890457) is 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is CN(CC(F)(F)F)S(=O)(=O)c1c(NN)nc2sccn12.
What is the InChIKey of 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is GZCQGWXYFMKBOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N5O2S2/c1-15(4-8(9,10)11)20(17,18)6-5(14-12)13-7-16(6)2-3-19-7/h2-3,14H,4,12H2,1H3.
What are the key properties of 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 329.33 g/mol, XLogP of 0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 60890457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).