6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide

C11H17N5O3S2 — CID 60814666

IUPAC6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCC(NS(=O)(=O)c1c(NN)nc2sccn12)C1CCCO1
InChIInChI=1S/C11H17N5O3S2/c1-7(8-3-2-5-19-8)15-21(17,18)10-9(14-12)13-11-16(10)4-6-20-11/h4,6-8,14-15H,2-3,5,12H2,1H3
InChIKeyJHPRDBKDEGCVHY-UHFFFAOYSA-N
MW331.42 g/mol
LogP0.53
Rot. Bonds5

About 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide

6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide (PubChem CID 60814666) has the molecular formula C11H17N5O3S2 and a molecular weight of 331.42 g/mol. Its IUPAC name is 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide.

Molecular Properties

Compound Name6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
PubChem CID60814666
Molecular FormulaC11H17N5O3S2
Molecular Weight331.42 g/mol
Exact Mass331.08
IUPAC Name6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
SMILESCC(NS(=O)(=O)c1c(NN)nc2sccn12)C1CCCO1
InChIInChI=1S/C11H17N5O3S2/c1-7(8-3-2-5-19-8)15-21(17,18)10-9(14-12)13-11-16(10)4-6-20-11/h4,6-8,14-15H,2-3,5,12H2,1H3
InChIKeyJHPRDBKDEGCVHY-UHFFFAOYSA-N
XLogP0.53
TPSA110.75 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 50.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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-(3-ethylpentan-2-yl)-6-hydrazinylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 63837318
[5-[(2R,6S)-2,6-dimethylpiperidin-1-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
CID 104967823
6-hydrazinyl-N-(7-oxabicyclo[2.2.1]heptan-2-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 80714351
[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
CID 104959246
[5-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylsulfonyl)imidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
CID 66370094
[5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
CID 61421703
6-hydrazinyl-N-(thiolan-3-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 107296956
2-[(6-hydrazinylimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylamino]acetamide
CID 60813647
4-hydrazinyl-2,6-dimethyl-N-[1-(oxolan-2-yl)ethyl]benzenesulfonamide
CID 107327853
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
2-chloro-N-[1-(oxolan-2-yl)ethyl]-1,3-thiazole-5-sulfonamide
CID 43533896

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The IUPAC name of 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide (CID 60814666) is 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide.
What is the SMILES notation for 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The canonical SMILES for 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide is CC(NS(=O)(=O)c1c(NN)nc2sccn12)C1CCCO1.
What is the InChIKey of 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
The InChIKey is JHPRDBKDEGCVHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O3S2/c1-7(8-3-2-5-19-8)15-21(17,18)10-9(14-12)13-11-16(10)4-6-20-11/h4,6-8,14-15H,2-3,5,12H2,1H3.
What are the key properties of 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide?
6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide has a molecular weight of 331.42 g/mol, XLogP of 0.53, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide is sourced from PubChem (CID 60814666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).