2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide

C25H19FN4OS — CID 16559351

IUPAC2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
SMILESCc1cccn2c(NC(=O)Cc3csc(-c4cccc(F)c4)n3)c(-c3ccccc3)nc12
InChIInChI=1S/C25H19FN4OS/c1-16-7-6-12-30-23(16)29-22(17-8-3-2-4-9-17)24(30)28-21(31)14-20-15-32-25(27-20)18-10-5-11-19(26)13-18/h2-13,15H,14H2,1H3,(H,28,31)
InChIKeyXNBGWSIUGJXLID-UHFFFAOYSA-N
MW442.52 g/mol
LogP5.75
Rot. Bonds5

About 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide

2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide (PubChem CID 16559351) has the molecular formula C25H19FN4OS and a molecular weight of 442.52 g/mol. Its IUPAC name is 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide.

Molecular Properties

Compound Name2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
PubChem CID16559351
Molecular FormulaC25H19FN4OS
Molecular Weight442.52 g/mol
Exact Mass442.13
IUPAC Name2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
SMILESCc1cccn2c(NC(=O)Cc3csc(-c4cccc(F)c4)n3)c(-c3ccccc3)nc12
InChIInChI=1S/C25H19FN4OS/c1-16-7-6-12-30-23(16)29-22(17-8-3-2-4-9-17)24(30)28-21(31)14-20-15-32-25(27-20)18-10-5-11-19(26)13-18/h2-13,15H,14H2,1H3,(H,28,31)
InChIKeyXNBGWSIUGJXLID-UHFFFAOYSA-N
XLogP5.75
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.52
LogP ≤ 55.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,4-difluorophenyl)sulfanyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 18278657
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CID 51603172
2-[[2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]acetyl]amino]butanoic acid
CID 119223235
2-(3-fluorophenyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)acetamide
CID 25390779
2-[2-(3-bromophenyl)-1,3-thiazol-4-yl]-N-(2-methylphenyl)acetamide
CID 30267673
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CID 86977217
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CID 8850099
2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(2-hydroxyethyl)acetamide
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2-[2-(3-chlorophenyl)-1,3-thiazol-4-yl]-N-(4-fluoro-2-methylphenyl)acetamide
CID 16560761
2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-[2-(2-methylbenzimidazol-1-yl)ethyl]acetamide
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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide?
The IUPAC name of 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide (CID 16559351) is 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide.
What is the SMILES notation for 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide?
The canonical SMILES for 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide is Cc1cccn2c(NC(=O)Cc3csc(-c4cccc(F)c4)n3)c(-c3ccccc3)nc12.
What is the InChIKey of 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide?
The InChIKey is XNBGWSIUGJXLID-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19FN4OS/c1-16-7-6-12-30-23(16)29-22(17-8-3-2-4-9-17)24(30)28-21(31)14-20-15-32-25(27-20)18-10-5-11-19(26)13-18/h2-13,15H,14H2,1H3,(H,28,31).
What are the key properties of 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide?
2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide has a molecular weight of 442.52 g/mol, XLogP of 5.75, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide is sourced from PubChem (CID 16559351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).