1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone

C8H8N2OS — CID 5056872

IUPAC1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone
SMILESCC(=O)c1c(C)nc2sccn12
InChIInChI=1S/C8H8N2OS/c1-5-7(6(2)11)10-3-4-12-8(10)9-5/h3-4H,1-2H3
InChIKeyUOGOENQNMWUIRE-UHFFFAOYSA-N
MW180.23 g/mol
LogP1.91
Rot. Bonds1

About 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone

1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone (PubChem CID 5056872) has the molecular formula C8H8N2OS and a molecular weight of 180.23 g/mol. Its IUPAC name is 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone.

Molecular Properties

Compound Name1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone
PubChem CID5056872
Molecular FormulaC8H8N2OS
Molecular Weight180.23 g/mol
Exact Mass180.04
IUPAC Name1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone
SMILESCC(=O)c1c(C)nc2sccn12
InChIInChI=1S/C8H8N2OS/c1-5-7(6(2)11)10-3-4-12-8(10)9-5/h3-4H,1-2H3
InChIKeyUOGOENQNMWUIRE-UHFFFAOYSA-N
XLogP1.91
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone?
The IUPAC name of 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone (CID 5056872) is 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone.
What is the SMILES notation for 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone?
The canonical SMILES for 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone is CC(=O)c1c(C)nc2sccn12.
What is the InChIKey of 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone?
The InChIKey is UOGOENQNMWUIRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2OS/c1-5-7(6(2)11)10-3-4-12-8(10)9-5/h3-4H,1-2H3.
What are the key properties of 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone?
1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone has a molecular weight of 180.23 g/mol, XLogP of 1.91, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone is sourced from PubChem (CID 5056872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).