2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide

C21H20N4O2S — CID 121038398

IUPAC2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide
SMILESCCOc1ccc(-c2cn3c(CC(=O)Nc4cc(C)ccn4)csc3n2)cc1
InChIInChI=1S/C21H20N4O2S/c1-3-27-17-6-4-15(5-7-17)18-12-25-16(13-28-21(25)23-18)11-20(26)24-19-10-14(2)8-9-22-19/h4-10,12-13H,3,11H2,1-2H3,(H,22,24,26)
InChIKeyWDHIVZMQXSDVHD-UHFFFAOYSA-N
MW392.48 g/mol
LogP4.35
Rot. Bonds6

About 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide

2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide (PubChem CID 121038398) has the molecular formula C21H20N4O2S and a molecular weight of 392.48 g/mol. Its IUPAC name is 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide
PubChem CID121038398
Molecular FormulaC21H20N4O2S
Molecular Weight392.48 g/mol
Exact Mass392.13
IUPAC Name2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide
SMILESCCOc1ccc(-c2cn3c(CC(=O)Nc4cc(C)ccn4)csc3n2)cc1
InChIInChI=1S/C21H20N4O2S/c1-3-27-17-6-4-15(5-7-17)18-12-25-16(13-28-21(25)23-18)11-20(26)24-19-10-14(2)8-9-22-19/h4-10,12-13H,3,11H2,1-2H3,(H,22,24,26)
InChIKeyWDHIVZMQXSDVHD-UHFFFAOYSA-N
XLogP4.35
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-methylacetamide
CID 40509194
N-(3-chloro-4-methylphenyl)-2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
CID 29044362
2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(2-fluorophenyl)acetamide
CID 40509257
N-[4-(diethylamino)-2-methylphenyl]-2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
CID 121038356
2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]acetamide
CID 121038392
N-(3,3-diphenylpropyl)-2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
CID 29044406
N-(4-ethoxyphenyl)-2-[6-(3-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
CID 40509577
2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(2-phenylethyl)acetamide
CID 40509284
N-[1-(4-ethoxyphenyl)ethyl]-2-(6-phenylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide
CID 42928562
N-[(1S)-1-(4-ethoxyphenyl)ethyl]-2-(6-phenylimidazo[2,1-b][1,3]thiazol-3-yl)acetamide
CID 25389385
N-[(2-chlorophenyl)methyl]-2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
CID 29044370
N-[3-(diethylamino)propyl]-2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetamide
CID 40509217

Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide (CID 121038398) is 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide is CCOc1ccc(-c2cn3c(CC(=O)Nc4cc(C)ccn4)csc3n2)cc1.
What is the InChIKey of 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide?
The InChIKey is WDHIVZMQXSDVHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2S/c1-3-27-17-6-4-15(5-7-17)18-12-25-16(13-28-21(25)23-18)11-20(26)24-19-10-14(2)8-9-22-19/h4-10,12-13H,3,11H2,1-2H3,(H,22,24,26).
What are the key properties of 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide?
2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide has a molecular weight of 392.48 g/mol, XLogP of 4.35, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-ethoxyphenyl)imidazo[2,1-b][1,3]thiazol-3-yl]-N-(4-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 121038398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).