N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide

C22H16N4OS2 — CID 24661436

IUPACN-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2ccsc2)sc1C(=O)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C22H16N4OS2/c1-14-20(29-22(23-14)16-9-11-28-13-16)21(27)24-17-7-5-15(6-8-17)18-12-26-10-3-2-4-19(26)25-18/h2-13H,1H3,(H,24,27)
InChIKeyODCQFYNQMWXJMV-UHFFFAOYSA-N
MW416.53 g/mol
LogP5.75
Rot. Bonds4

About N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide

N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide (PubChem CID 24661436) has the molecular formula C22H16N4OS2 and a molecular weight of 416.53 g/mol. Its IUPAC name is N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide
PubChem CID24661436
Molecular FormulaC22H16N4OS2
Molecular Weight416.53 g/mol
Exact Mass416.08
IUPAC NameN-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2ccsc2)sc1C(=O)Nc1ccc(-c2cn3ccccc3n2)cc1
InChIInChI=1S/C22H16N4OS2/c1-14-20(29-22(23-14)16-9-11-28-13-16)21(27)24-17-7-5-15(6-8-17)18-12-26-10-3-2-4-19(26)25-18/h2-13H,1H3,(H,24,27)
InChIKeyODCQFYNQMWXJMV-UHFFFAOYSA-N
XLogP5.75
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.53
LogP ≤ 55.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-methyl-N-phenyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide
CID 8871070
N-(2-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
CID 121148887
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
CID 4877017
N-(3,5-dimethylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide
CID 17497475
4-bromo-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)thiophene-2-carboxamide
CID 122284100
N-(3-acetylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide
CID 9078887
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-3-methylbenzamide
CID 40570291
N-[4-(1-cyclopropyltetrazol-5-yl)phenyl]-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide
CID 31404653
2,5-dichloro-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)thiophene-3-carboxamide
CID 41451826
2-bromo-N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzamide
CID 3763346
4-methyl-N-(3-methylsulfonylphenyl)-2-thiophen-3-yl-1,3-thiazole-5-carboxamide
CID 25497583
ethane;N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methoxy-2-methylbenzamide
CID 123200330

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide (CID 24661436) is N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide is Cc1nc(-c2ccsc2)sc1C(=O)Nc1ccc(-c2cn3ccccc3n2)cc1.
What is the InChIKey of N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide?
The InChIKey is ODCQFYNQMWXJMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4OS2/c1-14-20(29-22(23-14)16-9-11-28-13-16)21(27)24-17-7-5-15(6-8-17)18-12-26-10-3-2-4-19(26)25-18/h2-13H,1H3,(H,24,27).
What are the key properties of N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide?
N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide has a molecular weight of 416.53 g/mol, XLogP of 5.75, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazo[1,2-a]pyridin-2-ylphenyl)-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 24661436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).