3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane

C9H14N2S — CID 142873849

IUPAC3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane
SMILESCC.Cc1cn2c(C)csc2n1
InChIInChI=1S/C7H8N2S.C2H6/c1-5-3-9-6(2)4-10-7(9)8-5;1-2/h3-4H,1-2H3;1-2H3
InChIKeyLUXCJJJEDALRMR-UHFFFAOYSA-N
MW182.29 g/mol
LogP3.04
Rot. Bonds

About 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane

3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane (PubChem CID 142873849) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane.

Molecular Properties

Compound Name3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane
PubChem CID142873849
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC Name3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane
SMILESCC.Cc1cn2c(C)csc2n1
InChIInChI=1S/C7H8N2S.C2H6/c1-5-3-9-6(2)4-10-7(9)8-5;1-2/h3-4H,1-2H3;1-2H3
InChIKeyLUXCJJJEDALRMR-UHFFFAOYSA-N
XLogP3.04
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane?
The IUPAC name of 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane (CID 142873849) is 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane.
What is the SMILES notation for 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane?
The canonical SMILES for 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane is CC.Cc1cn2c(C)csc2n1.
What is the InChIKey of 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane?
The InChIKey is LUXCJJJEDALRMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2S.C2H6/c1-5-3-9-6(2)4-10-7(9)8-5;1-2/h3-4H,1-2H3;1-2H3.
What are the key properties of 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane?
3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane has a molecular weight of 182.29 g/mol, XLogP of 3.04, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethylimidazo[2,1-b][1,3]thiazole;ethane is sourced from PubChem (CID 142873849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).