N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide

C22H16N6OS — CID 55874614

IUPACN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
SMILESCc1cccn2c(NC(=O)c3csc(-c4ncccn4)n3)c(-c3ccccc3)nc12
InChIInChI=1S/C22H16N6OS/c1-14-7-5-12-28-19(14)26-17(15-8-3-2-4-9-15)20(28)27-21(29)16-13-30-22(25-16)18-23-10-6-11-24-18/h2-13H,1H3,(H,27,29)
InChIKeyYBVMZVUHCWDYPF-UHFFFAOYSA-N
MW412.48 g/mol
LogP4.48
Rot. Bonds4

About N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide

N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide (PubChem CID 55874614) has the molecular formula C22H16N6OS and a molecular weight of 412.48 g/mol. Its IUPAC name is N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
PubChem CID55874614
Molecular FormulaC22H16N6OS
Molecular Weight412.48 g/mol
Exact Mass412.11
IUPAC NameN-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
SMILESCc1cccn2c(NC(=O)c3csc(-c4ncccn4)n3)c(-c3ccccc3)nc12
InChIInChI=1S/C22H16N6OS/c1-14-7-5-12-28-19(14)26-17(15-8-3-2-4-9-15)20(28)27-21(29)16-13-30-22(25-16)18-23-10-6-11-24-18/h2-13H,1H3,(H,27,29)
InChIKeyYBVMZVUHCWDYPF-UHFFFAOYSA-N
XLogP4.48
TPSA85.07 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.48
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-methyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-1,2-oxazole-3-carboxamide
CID 60520237
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-4-pyrazol-1-ylbenzamide
CID 55369681
4-methyl-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-thiophen-2-yl-1,3-thiazole-5-carboxamide
CID 27677602
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-5-(phenoxymethyl)furan-2-carboxamide
CID 46813428
2-[2-(3-fluorophenyl)-1,3-thiazol-4-yl]-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 16559351
N-(2-acetylphenyl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
CID 60529832
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2,3-dihydro-1-benzothiophene-2-carboxamide
CID 55494966
N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)pyridine-2-carboxamide
CID 17417375
6-chloro-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxamide
CID 55388971
4-(2-methyl-4-oxoquinazolin-3-yl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 46813436
5-ethoxy-4-methoxy-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-nitrobenzamide
CID 34075368
4-chloro-3-(diethylsulfamoyl)-N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
CID 46813394

Frequently Asked Questions

What is the IUPAC name of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide (CID 55874614) is N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide is Cc1cccn2c(NC(=O)c3csc(-c4ncccn4)n3)c(-c3ccccc3)nc12.
What is the InChIKey of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide?
The InChIKey is YBVMZVUHCWDYPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N6OS/c1-14-7-5-12-28-19(14)26-17(15-8-3-2-4-9-15)20(28)27-21(29)16-13-30-22(25-16)18-23-10-6-11-24-18/h2-13H,1H3,(H,27,29).
What are the key properties of N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide?
N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide has a molecular weight of 412.48 g/mol, XLogP of 4.48, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 55874614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).