1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone

C20H17N3OS — CID 158000545

IUPAC1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone
SMILESCc1cccc(-c2cc(C(=O)Cc3nc(C)cs3)c3nccn3c2)c1
InChIInChI=1S/C20H17N3OS/c1-13-4-3-5-15(8-13)16-9-17(20-21-6-7-23(20)11-16)18(24)10-19-22-14(2)12-25-19/h3-9,11-12H,10H2,1-2H3
InChIKeyZIDLKDAQWCTHNN-UHFFFAOYSA-N
MW347.44 g/mol
LogP4.50
Rot. Bonds4

About 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone

1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone (PubChem CID 158000545) has the molecular formula C20H17N3OS and a molecular weight of 347.44 g/mol. Its IUPAC name is 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone.

Molecular Properties

Compound Name1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone
PubChem CID158000545
Molecular FormulaC20H17N3OS
Molecular Weight347.44 g/mol
Exact Mass347.11
IUPAC Name1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone
SMILESCc1cccc(-c2cc(C(=O)Cc3nc(C)cs3)c3nccn3c2)c1
InChIInChI=1S/C20H17N3OS/c1-13-4-3-5-15(8-13)16-9-17(20-21-6-7-23(20)11-16)18(24)10-19-22-14(2)12-25-19/h3-9,11-12H,10H2,1-2H3
InChIKeyZIDLKDAQWCTHNN-UHFFFAOYSA-N
XLogP4.50
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.44
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone with MolForge

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Related Compounds

2-(4-methyl-1,3-thiazol-2-yl)-1-(6-pyridazin-4-ylimidazo[1,2-a]pyridin-8-yl)ethanone
CID 160547995
1-[6-(4-cyclopropyl-3-pyridinyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 161034340
1-(2-bromo-4-methylphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 115789277
2-(4-methyl-1,3-thiazol-2-yl)-1-quinolin-5-ylethanone
CID 81220404
1-[6-(4-ethyl-3-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 158772673
2-(4-methyl-1,3-thiazol-2-yl)-1-(1-propylimidazol-2-yl)ethanone
CID 63975439
1-[4-(3-methylphenyl)-1,3-thiazol-2-yl]propan-2-one
CID 116966447
1-(2,4-dihydroxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 728377
1-(2,5-dichlorophenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 60977248
1-(5-chloro-2-fluorophenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 115586851
N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide
CID 110484461
1-(2-methoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 55023762

Frequently Asked Questions

What is the IUPAC name of 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone?
The IUPAC name of 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone (CID 158000545) is 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone.
What is the SMILES notation for 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone?
The canonical SMILES for 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone is Cc1cccc(-c2cc(C(=O)Cc3nc(C)cs3)c3nccn3c2)c1.
What is the InChIKey of 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone?
The InChIKey is ZIDLKDAQWCTHNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3OS/c1-13-4-3-5-15(8-13)16-9-17(20-21-6-7-23(20)11-16)18(24)10-19-22-14(2)12-25-19/h3-9,11-12H,10H2,1-2H3.
What are the key properties of 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone?
1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone has a molecular weight of 347.44 g/mol, XLogP of 4.50, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(3-methylphenyl)imidazo[1,2-a]pyridin-8-yl]-2-(4-methyl-1,3-thiazol-2-yl)ethanone is sourced from PubChem (CID 158000545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).