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

C9H10N2OS — CID 15026033

IUPAC1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone
SMILESCC(=O)c1c(C)nc2sc(C)cn12
InChIInChI=1S/C9H10N2OS/c1-5-4-11-8(7(3)12)6(2)10-9(11)13-5/h4H,1-3H3
InChIKeyXKSSOIQVNPKPGR-UHFFFAOYSA-N
MW194.26 g/mol
LogP2.22
Rot. Bonds1

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

1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone (PubChem CID 15026033) has the molecular formula C9H10N2OS and a molecular weight of 194.26 g/mol. Its IUPAC name is 1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone.

Molecular Properties

Compound Name1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone
PubChem CID15026033
Molecular FormulaC9H10N2OS
Molecular Weight194.26 g/mol
Exact Mass194.05
IUPAC Name1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone
SMILESCC(=O)c1c(C)nc2sc(C)cn12
InChIInChI=1S/C9H10N2OS/c1-5-4-11-8(7(3)12)6(2)10-9(11)13-5/h4H,1-3H3
InChIKeyXKSSOIQVNPKPGR-UHFFFAOYSA-N
XLogP2.22
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone?
The IUPAC name of 1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone (CID 15026033) is 1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone.
What is the SMILES notation for 1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone?
The canonical SMILES for 1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone is CC(=O)c1c(C)nc2sc(C)cn12.
What is the InChIKey of 1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone?
The InChIKey is XKSSOIQVNPKPGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2OS/c1-5-4-11-8(7(3)12)6(2)10-9(11)13-5/h4H,1-3H3.
What are the key properties of 1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone?
1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone has a molecular weight of 194.26 g/mol, XLogP of 2.22, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanone is sourced from PubChem (CID 15026033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).