1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone

C15H14N2OS — CID 19224511

IUPAC1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone
SMILESCC(=O)c1sc2nc(-c3ccc(C)cc3)cn2c1C
InChIInChI=1S/C15H14N2OS/c1-9-4-6-12(7-5-9)13-8-17-10(2)14(11(3)18)19-15(17)16-13/h4-8H,1-3H3
InChIKeyDKZITTMNCYUEBM-UHFFFAOYSA-N
MW270.36 g/mol
LogP3.88
Rot. Bonds2

About 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone

1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone (PubChem CID 19224511) has the molecular formula C15H14N2OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone.

Molecular Properties

Compound Name1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone
PubChem CID19224511
Molecular FormulaC15H14N2OS
Molecular Weight270.36 g/mol
Exact Mass270.08
IUPAC Name1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone
SMILESCC(=O)c1sc2nc(-c3ccc(C)cc3)cn2c1C
InChIInChI=1S/C15H14N2OS/c1-9-4-6-12(7-5-9)13-8-17-10(2)14(11(3)18)19-15(17)16-13/h4-8H,1-3H3
InChIKeyDKZITTMNCYUEBM-UHFFFAOYSA-N
XLogP3.88
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone?
The IUPAC name of 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone (CID 19224511) is 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone.
What is the SMILES notation for 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone?
The canonical SMILES for 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone is CC(=O)c1sc2nc(-c3ccc(C)cc3)cn2c1C.
What is the InChIKey of 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone?
The InChIKey is DKZITTMNCYUEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS/c1-9-4-6-12(7-5-9)13-8-17-10(2)14(11(3)18)19-15(17)16-13/h4-8H,1-3H3.
What are the key properties of 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone?
1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone has a molecular weight of 270.36 g/mol, XLogP of 3.88, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-methyl-6-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanone is sourced from PubChem (CID 19224511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).