N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide

C20H17N3OS — CID 90625793

IUPACN-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccccc2-c2cn3ccsc3n2)cc1C
InChIInChI=1S/C20H17N3OS/c1-13-7-8-15(11-14(13)2)19(24)21-17-6-4-3-5-16(17)18-12-23-9-10-25-20(23)22-18/h3-12H,1-2H3,(H,21,24)
InChIKeySIUMROGIRYFBGI-UHFFFAOYSA-N
MW347.44 g/mol
LogP4.93
Rot. Bonds3

About N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide

N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide (PubChem CID 90625793) has the molecular formula C20H17N3OS and a molecular weight of 347.44 g/mol. Its IUPAC name is N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide
PubChem CID90625793
Molecular FormulaC20H17N3OS
Molecular Weight347.44 g/mol
Exact Mass347.11
IUPAC NameN-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccccc2-c2cn3ccsc3n2)cc1C
InChIInChI=1S/C20H17N3OS/c1-13-7-8-15(11-14(13)2)19(24)21-17-6-4-3-5-16(17)18-12-23-9-10-25-20(23)22-18/h3-12H,1-2H3,(H,21,24)
InChIKeySIUMROGIRYFBGI-UHFFFAOYSA-N
XLogP4.93
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.44
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-fluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-4-methoxybenzamide
CID 90626010
N-(3-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide
CID 40506197
3,4-dimethyl-N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 90626115
2-fluoro-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)benzamide
CID 90625740
(E)-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)but-2-enamide
CID 90625813
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3-methyl-6-phenylimidazo[2,1-b][1,3]thiazole-2-carboxamide
CID 90626025
3-(2-chlorophenyl)-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 90625926
6-(2-methylphenyl)imidazo[2,1-b][1,3]thiazole
CID 115403259
1-(2,5-dichlorophenyl)-3-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)urea
CID 90626818
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-6-methoxy-1H-indole-2-carboxamide
CID 90625987
2-(4-bromophenyl)-N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide
CID 90625768
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)propane-2-sulfonamide
CID 90626781

Frequently Asked Questions

What is the IUPAC name of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide?
The IUPAC name of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide (CID 90625793) is N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide.
What is the SMILES notation for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide?
The canonical SMILES for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide is Cc1ccc(C(=O)Nc2ccccc2-c2cn3ccsc3n2)cc1C.
What is the InChIKey of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide?
The InChIKey is SIUMROGIRYFBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3OS/c1-13-7-8-15(11-14(13)2)19(24)21-17-6-4-3-5-16(17)18-12-23-9-10-25-20(23)22-18/h3-12H,1-2H3,(H,21,24).
What are the key properties of N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide?
N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide has a molecular weight of 347.44 g/mol, XLogP of 4.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)-3,4-dimethylbenzamide is sourced from PubChem (CID 90625793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).