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

C16H14F3N3OS — CID 31184804

IUPAC2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
SMILESCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cn2ccsc2n1
InChIInChI=1S/C16H14F3N3OS/c1-21(9-11-2-4-12(5-3-11)16(17,18)19)14(23)8-13-10-22-6-7-24-15(22)20-13/h2-7,10H,8-9H2,1H3
InChIKeyFGHZWRKJRYCHAA-UHFFFAOYSA-N
MW353.37 g/mol
LogP3.62
Rot. Bonds4

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

2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide (PubChem CID 31184804) has the molecular formula C16H14F3N3OS and a molecular weight of 353.37 g/mol. Its IUPAC name is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
PubChem CID31184804
Molecular FormulaC16H14F3N3OS
Molecular Weight353.37 g/mol
Exact Mass353.08
IUPAC Name2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide
SMILESCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cn2ccsc2n1
InChIInChI=1S/C16H14F3N3OS/c1-21(9-11-2-4-12(5-3-11)16(17,18)19)14(23)8-13-10-22-6-7-24-15(22)20-13/h2-7,10H,8-9H2,1H3
InChIKeyFGHZWRKJRYCHAA-UHFFFAOYSA-N
XLogP3.62
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.37
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide?
The IUPAC name of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide (CID 31184804) is 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide is CN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cn2ccsc2n1.
What is the InChIKey of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide?
The InChIKey is FGHZWRKJRYCHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3N3OS/c1-21(9-11-2-4-12(5-3-11)16(17,18)19)14(23)8-13-10-22-6-7-24-15(22)20-13/h2-7,10H,8-9H2,1H3.
What are the key properties of 2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide?
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-N-[[4-(trifluoromethyl)phenyl]methyl]acetamide has a molecular weight of 353.37 g/mol, XLogP of 3.62, 4 rotatable bonds, 0 hydrogen bond donors, and 4 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-[[4-(trifluoromethyl)phenyl]methyl]acetamide is sourced from PubChem (CID 31184804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).