[5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine

C12H19N5O2S2 — CID 61421703

IUPAC[5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
SMILESCCC1CCN(S(=O)(=O)c2c(NN)nc3sccn23)CC1
InChIInChI=1S/C12H19N5O2S2/c1-2-9-3-5-16(6-4-9)21(18,19)11-10(15-13)14-12-17(11)7-8-20-12/h7-9,15H,2-6,13H2,1H3
InChIKeyOVGNHYUEIZEFOQ-UHFFFAOYSA-N
MW329.45 g/mol
LogP1.49
Rot. Bonds4

About [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine

[5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine (PubChem CID 61421703) has the molecular formula C12H19N5O2S2 and a molecular weight of 329.45 g/mol. Its IUPAC name is [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine.

Molecular Properties

Compound Name[5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
PubChem CID61421703
Molecular FormulaC12H19N5O2S2
Molecular Weight329.45 g/mol
Exact Mass329.10
IUPAC Name[5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
SMILESCCC1CCN(S(=O)(=O)c2c(NN)nc3sccn23)CC1
InChIInChI=1S/C12H19N5O2S2/c1-2-9-3-5-16(6-4-9)21(18,19)11-10(15-13)14-12-17(11)7-8-20-12/h7-9,15H,2-6,13H2,1H3
InChIKeyOVGNHYUEIZEFOQ-UHFFFAOYSA-N
XLogP1.49
TPSA92.73 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.45
LogP ≤ 51.49
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

[1-(6-hydrazinylimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylpyrrolidin-3-yl]methanol
CID 115965507
[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-[(2R,6S)-2,6-dimethylpiperidin-1-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
CID 104967823
N-ethyl-5-(3-methylpyrrolidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine
CID 62147094
[1-(6-hydrazinylimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-3-methylpyrrolidin-2-yl]methanol
CID 102782000
N-propyl-5-thiomorpholin-4-ylsulfonylimidazo[2,1-b][1,3]thiazol-6-amine
CID 62144057
6-hydrazinyl-N-(7-oxabicyclo[2.2.1]heptan-2-yl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 80714351
N-cyclohexyl-6-hydrazinyl-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 60814489
5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 103538307
6-hydrazinyl-N-(thiolan-3-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 107296956
5-(3,4-dimethylpyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 79180679

Frequently Asked Questions

What is the IUPAC name of [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine?
The IUPAC name of [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine (CID 61421703) is [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine.
What is the SMILES notation for [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine?
The canonical SMILES for [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine is CCC1CCN(S(=O)(=O)c2c(NN)nc3sccn23)CC1.
What is the InChIKey of [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine?
The InChIKey is OVGNHYUEIZEFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2S2/c1-2-9-3-5-16(6-4-9)21(18,19)11-10(15-13)14-12-17(11)7-8-20-12/h7-9,15H,2-6,13H2,1H3.
What are the key properties of [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine?
[5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine has a molecular weight of 329.45 g/mol, XLogP of 1.49, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine is sourced from PubChem (CID 61421703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).