5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine

C12H18N4O3S2 — CID 62147550

IUPAC5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCCC1COCCN1S(=O)(=O)c1c(NC)nc2sccn12
InChIInChI=1S/C12H18N4O3S2/c1-3-9-8-19-6-4-16(9)21(17,18)11-10(13-2)14-12-15(11)5-7-20-12/h5,7,9,13H,3-4,6,8H2,1-2H3
InChIKeyIJLWZFCKRJZCGO-UHFFFAOYSA-N
MW330.44 g/mol
LogP1.24
Rot. Bonds4

About 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine

5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 62147550) has the molecular formula C12H18N4O3S2 and a molecular weight of 330.44 g/mol. Its IUPAC name is 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID62147550
Molecular FormulaC12H18N4O3S2
Molecular Weight330.44 g/mol
Exact Mass330.08
IUPAC Name5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
SMILESCCC1COCCN1S(=O)(=O)c1c(NC)nc2sccn12
InChIInChI=1S/C12H18N4O3S2/c1-3-9-8-19-6-4-16(9)21(17,18)11-10(13-2)14-12-15(11)5-7-20-12/h5,7,9,13H,3-4,6,8H2,1-2H3
InChIKeyIJLWZFCKRJZCGO-UHFFFAOYSA-N
XLogP1.24
TPSA75.94 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.44
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-(2,5-dimethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 62145564
5-(3,4-dimethylpyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 79180679
5-[(2S,6R)-2,6-dimethylpiperidin-1-yl]sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 104968740
5-(3-methoxypyrrolidin-1-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine
CID 103538307
[5-(4-ethylpiperidin-1-yl)sulfonylimidazo[2,1-b][1,3]thiazol-6-yl]hydrazine
CID 61421703
N,N-dimethyl-6-(methylamino)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62149455
N-cyclobutyl-6-(methylamino)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62415032
N-butyl-N-methyl-6-(methylamino)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62162472
N-tert-butyl-6-(methylamino)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 62149826
[1-(6-hydrazinylimidazo[2,1-b][1,3]thiazol-5-yl)sulfonyl-3-methylpyrrolidin-2-yl]methanol
CID 102782000
6-(methylamino)-N-(thiolan-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 80586000
N-methyl-6-(methylamino)-N-[(2-methylcyclopropyl)methyl]imidazo[2,1-b][1,3]thiazole-5-sulfonamide
CID 63859228

Frequently Asked Questions

What is the IUPAC name of 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine (CID 62147550) is 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine is CCC1COCCN1S(=O)(=O)c1c(NC)nc2sccn12.
What is the InChIKey of 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is IJLWZFCKRJZCGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O3S2/c1-3-9-8-19-6-4-16(9)21(17,18)11-10(13-2)14-12-15(11)5-7-20-12/h5,7,9,13H,3-4,6,8H2,1-2H3.
What are the key properties of 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine?
5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 330.44 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethylmorpholin-4-yl)sulfonyl-N-methylimidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 62147550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).