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

C18H17N5OS — CID 31645281

IUPAC2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide
SMILESCN(Cc1cnn(-c2ccccc2)c1)C(=O)Cc1cn2ccsc2n1
InChIInChI=1S/C18H17N5OS/c1-21(17(24)9-15-13-22-7-8-25-18(22)20-15)11-14-10-19-23(12-14)16-5-3-2-4-6-16/h2-8,10,12-13H,9,11H2,1H3
InChIKeyGFYKTAHGOYWBFO-UHFFFAOYSA-N
MW351.44 g/mol
LogP2.78
Rot. Bonds5

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

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide (PubChem CID 31645281) has the molecular formula C18H17N5OS and a molecular weight of 351.44 g/mol. Its IUPAC name is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide
PubChem CID31645281
Molecular FormulaC18H17N5OS
Molecular Weight351.44 g/mol
Exact Mass351.12
IUPAC Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide
SMILESCN(Cc1cnn(-c2ccccc2)c1)C(=O)Cc1cn2ccsc2n1
InChIInChI=1S/C18H17N5OS/c1-21(17(24)9-15-13-22-7-8-25-18(22)20-15)11-14-10-19-23(12-14)16-5-3-2-4-6-16/h2-8,10,12-13H,9,11H2,1H3
InChIKeyGFYKTAHGOYWBFO-UHFFFAOYSA-N
XLogP2.78
TPSA55.43 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.44
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(3-pyrazol-1-ylphenyl)methyl]acetamide
CID 70769748
N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-2-sulfanylacetamide
CID 122174227
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 134047252
2-(1H-indol-3-yl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide
CID 8950246
N-benzyl-N-cyclopropyl-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 38252253
methyl 2-[(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)-methylamino]acetate
CID 43408802
N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 17471481
2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide
CID 8961867
N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 8962276
N-methyl-4-[[methyl-[2-(1-phenylpyrazol-4-yl)acetyl]amino]methyl]benzamide
CID 38744068
2-(5-chloro-2-methoxyphenyl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide
CID 8962293
N-methyl-2-(2-methyl-1H-indol-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]acetamide
CID 31960924

Frequently Asked Questions

What is the IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide?
The IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide (CID 31645281) is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide.
What is the SMILES notation for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide?
The canonical SMILES for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide is CN(Cc1cnn(-c2ccccc2)c1)C(=O)Cc1cn2ccsc2n1.
What is the InChIKey of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide?
The InChIKey is GFYKTAHGOYWBFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5OS/c1-21(17(24)9-15-13-22-7-8-25-18(22)20-15)11-14-10-19-23(12-14)16-5-3-2-4-6-16/h2-8,10,12-13H,9,11H2,1H3.
What are the key properties of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide?
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide has a molecular weight of 351.44 g/mol, XLogP of 2.78, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]acetamide is sourced from PubChem (CID 31645281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).