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

C12H18N4O2S2 — CID 62332050

IUPAC5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCC1CCN(S(=O)(=O)c2c(N)nc3sccn23)C(C)C1
InChIInChI=1S/C12H18N4O2S2/c1-8-3-4-16(9(2)7-8)20(17,18)11-10(13)14-12-15(11)5-6-19-12/h5-6,8-9H,3-4,7,13H2,1-2H3
InChIKeyRYKGUULQVDXYFH-UHFFFAOYSA-N
MW314.44 g/mol
LogP1.79
Rot. Bonds2

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

5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 62332050) has the molecular formula C12H18N4O2S2 and a molecular weight of 314.44 g/mol. Its IUPAC name is 5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID62332050
Molecular FormulaC12H18N4O2S2
Molecular Weight314.44 g/mol
Exact Mass314.09
IUPAC Name5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCC1CCN(S(=O)(=O)c2c(N)nc3sccn23)C(C)C1
InChIInChI=1S/C12H18N4O2S2/c1-8-3-4-16(9(2)7-8)20(17,18)11-10(13)14-12-15(11)5-6-19-12/h5-6,8-9H,3-4,7,13H2,1-2H3
InChIKeyRYKGUULQVDXYFH-UHFFFAOYSA-N
XLogP1.79
TPSA80.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.44
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(4-ethyl-3-methylpiperazin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine
CID 63604950
5-(4-methoxypiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine
CID 62145336
5-piperidin-1-ylsulfonylimidazo[2,1-b][1,3]thiazol-6-amine
CID 62143175
6-amino-N-(4-methylcyclohexyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62149971
6-chloro-5-(2-methylpyrrolidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazole
CID 54882392
1-(6-aminoimidazo[2,1-b][1,3]thiazol-5-yl)sulfonylpiperidin-3-ol
CID 62153628
6-amino-N,N-dimethylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62150681
[1-(6-hydrazinylimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-3-methylpyrrolidin-2-yl]methanol
CID 102782000
6-amino-N-(cyclobutylmethyl)-N-methylimidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62856273
[5-[(2R,6S)-2,6-dimethylpiperidin-1-yl]sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
CID 104967823
6-amino-N-(2-pyrrolidin-1-ylethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62640219
6-amino-N-(2-piperidin-1-ylethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62156779

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine (CID 62332050) is 5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine is CC1CCN(S(=O)(=O)c2c(N)nc3sccn23)C(C)C1.
What is the InChIKey of 5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is RYKGUULQVDXYFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2S2/c1-8-3-4-16(9(2)7-8)20(17,18)11-10(13)14-12-15(11)5-6-19-12/h5-6,8-9H,3-4,7,13H2,1-2H3.
What are the key properties of 5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine?
5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 314.44 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dimethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 62332050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).