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

C11H17N5O3S2 — CID 104959246

IUPAC[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
SMILESC[C@@H]1CN(S(=O)(=O)c2c(NN)nc3sccn23)C[C@H](C)O1
InChIInChI=1S/C11H17N5O3S2/c1-7-5-15(6-8(2)19-7)21(17,18)10-9(14-12)13-11-16(10)3-4-20-11/h3-4,7-8,14H,5-6,12H2,1-2H3/t7-,8+
InChIKeyOVOUAFAHGFEGDM-OCAPTIKFSA-N
MW331.42 g/mol
LogP0.48
Rot. Bonds3

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

[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine (PubChem CID 104959246) has the molecular formula C11H17N5O3S2 and a molecular weight of 331.42 g/mol. Its IUPAC name is [5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine.

Molecular Properties

Compound Name[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
PubChem CID104959246
Molecular FormulaC11H17N5O3S2
Molecular Weight331.42 g/mol
Exact Mass331.08
IUPAC Name[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
SMILESC[C@@H]1CN(S(=O)(=O)c2c(NN)nc3sccn23)C[C@H](C)O1
InChIInChI=1S/C11H17N5O3S2/c1-7-5-15(6-8(2)19-7)21(17,18)10-9(14-12)13-11-16(10)3-4-20-11/h3-4,7-8,14H,5-6,12H2,1-2H3/t7-,8+
InChIKeyOVOUAFAHGFEGDM-OCAPTIKFSA-N
XLogP0.48
TPSA101.96 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 50.48
H-Bond Donors ≤ 52
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

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5-(3,4-dimethylpyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
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[5-[(2R,6S)-2,6-dimethylpiperidin-1-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
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[1-(6-hydrazinylimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylpyrrolidin-3-yl]methanol
CID 115965507
[1-(6-hydrazinylimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-3-methylpyrrolidin-2-yl]methanol
CID 102782000
N-ethyl-5-(3-methylpyrrolidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine
CID 62147094
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CID 60814489
5-(2,5-dimethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 62145564
6-hydrazinyl-N-morpholin-4-ylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 83025791
5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 103538307
6-hydrazinyl-N-[1-(oxolan-2-yl)ethyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
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Frequently Asked Questions

What is the IUPAC name of [5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine?
The IUPAC name of [5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine (CID 104959246) is [5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine.
What is the SMILES notation for [5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine?
The canonical SMILES for [5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine is C[C@@H]1CN(S(=O)(=O)c2c(NN)nc3sccn23)C[C@H](C)O1.
What is the InChIKey of [5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine?
The InChIKey is OVOUAFAHGFEGDM-OCAPTIKFSA-N. The full InChI is InChI=1S/C11H17N5O3S2/c1-7-5-15(6-8(2)19-7)21(17,18)10-9(14-12)13-11-16(10)3-4-20-11/h3-4,7-8,14H,5-6,12H2,1-2H3/t7-,8+.
What are the key properties of [5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine?
[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine has a molecular weight of 331.42 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine is sourced from PubChem (CID 104959246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).