5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine

C11H16N4O3S2 — CID 103538307

IUPAC5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCNc1nc2sccn2c1S(=O)(=O)N1CCC(OC)C1
InChIInChI=1S/C11H16N4O3S2/c1-12-9-10(15-5-6-19-11(15)13-9)20(16,17)14-4-3-8(7-14)18-2/h5-6,8,12H,3-4,7H2,1-2H3
InChIKeyFLAXYQNKMAXIKK-UHFFFAOYSA-N
MW316.41 g/mol
LogP0.85
Rot. Bonds4

About 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine

5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 103538307) has the molecular formula C11H16N4O3S2 and a molecular weight of 316.41 g/mol. Its IUPAC name is 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID103538307
Molecular FormulaC11H16N4O3S2
Molecular Weight316.41 g/mol
Exact Mass316.07
IUPAC Name5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCNc1nc2sccn2c1S(=O)(=O)N1CCC(OC)C1
InChIInChI=1S/C11H16N4O3S2/c1-12-9-10(15-5-6-19-11(15)13-9)20(16,17)14-4-3-8(7-14)18-2/h5-6,8,12H,3-4,7H2,1-2H3
InChIKeyFLAXYQNKMAXIKK-UHFFFAOYSA-N
XLogP0.85
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-(3,4-dimethylpyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 79180679
5-(4-methoxypiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine
CID 62145336
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)sulfonylpyrrolidin-3-yl]methanol
CID 115965507
5-[(2S,6R)-2,6-dimethylpiperidin-1-yl]sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 104968740
methyl 1-(6-chloroimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylpyrrolidine-3-carboxylate
CID 78926070
[5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
CID 61421703
N-cyclobutyl-6-(methylamino)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62415032
N,N-dimethyl-6-(methylamino)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62149455
[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-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 62147550

Frequently Asked Questions

What is the IUPAC name of 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine (CID 103538307) is 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine is CNc1nc2sccn2c1S(=O)(=O)N1CCC(OC)C1.
What is the InChIKey of 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is FLAXYQNKMAXIKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3S2/c1-12-9-10(15-5-6-19-11(15)13-9)20(16,17)14-4-3-8(7-14)18-2/h5-6,8,12H,3-4,7H2,1-2H3.
What are the key properties of 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 316.41 g/mol, XLogP of 0.85, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 103538307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).