2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide

C18H28N4OS — CID 51941748

IUPAC2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide
SMILESCC1CCN([C@@H](CNC(=O)Cc2cn3ccsc3n2)C(C)C)CC1
InChIInChI=1S/C18H28N4OS/c1-13(2)16(21-6-4-14(3)5-7-21)11-19-17(23)10-15-12-22-8-9-24-18(22)20-15/h8-9,12-14,16H,4-7,10-11H2,1-3H3,(H,19,23)/t16-/m0/s1
InChIKeyCERFTKABVBSHOV-INIZCTEOSA-N
MW348.52 g/mol
LogP2.81
Rot. Bonds6

About 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide (PubChem CID 51941748) has the molecular formula C18H28N4OS and a molecular weight of 348.52 g/mol. Its IUPAC name is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide.

Molecular Properties

Compound Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide
PubChem CID51941748
Molecular FormulaC18H28N4OS
Molecular Weight348.52 g/mol
Exact Mass348.20
IUPAC Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide
SMILESCC1CCN([C@@H](CNC(=O)Cc2cn3ccsc3n2)C(C)C)CC1
InChIInChI=1S/C18H28N4OS/c1-13(2)16(21-6-4-14(3)5-7-21)11-19-17(23)10-15-12-22-8-9-24-18(22)20-15/h8-9,12-14,16H,4-7,10-11H2,1-3H3,(H,19,23)/t16-/m0/s1
InChIKeyCERFTKABVBSHOV-INIZCTEOSA-N
XLogP2.81
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.52
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2S)-2-(4-methylpiperidin-1-yl)propyl]acetamide
CID 94812709
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-[(4R)-4-methylazepan-1-yl]ethanone
CID 95591217
3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-one
CID 115792010
2-(4-aminophenyl)-N-[3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide;dihydrochloride
CID 119849811
N-(2-ethylhexyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 134057702
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 51254649
N-[(2R)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 25324982
N-(2-hydroxy-2,4-dimethylpentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 66179467
methyl 3-[(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)amino]propanoate
CID 60690600
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-(2,2,2-trifluoroethyl)acetamide
CID 134025216
N-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonylethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 51941811
N-[2-(tert-butylamino)-2-oxoethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 31563729

Frequently Asked Questions

What is the IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide?
The IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide (CID 51941748) is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide.
What is the SMILES notation for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide?
The canonical SMILES for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide is CC1CCN([C@@H](CNC(=O)Cc2cn3ccsc3n2)C(C)C)CC1.
What is the InChIKey of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide?
The InChIKey is CERFTKABVBSHOV-INIZCTEOSA-N. The full InChI is InChI=1S/C18H28N4OS/c1-13(2)16(21-6-4-14(3)5-7-21)11-19-17(23)10-15-12-22-8-9-24-18(22)20-15/h8-9,12-14,16H,4-7,10-11H2,1-3H3,(H,19,23)/t16-/m0/s1.
What are the key properties of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide?
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide has a molecular weight of 348.52 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-[(2R)-3-methyl-2-(4-methylpiperidin-1-yl)butyl]acetamide is sourced from PubChem (CID 51941748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).