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

C13H11N3OS — CID 685797

IUPACN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide
SMILESCC(=O)Nc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C13H11N3OS/c1-9(17)14-11-4-2-10(3-5-11)12-8-16-6-7-18-13(16)15-12/h2-8H,1H3,(H,14,17)
InChIKeyJKOILEIYPNJUGJ-UHFFFAOYSA-N
MW257.32 g/mol
LogP3.02
Rot. Bonds2

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

N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide (PubChem CID 685797) has the molecular formula C13H11N3OS and a molecular weight of 257.32 g/mol. Its IUPAC name is N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide
PubChem CID685797
Molecular FormulaC13H11N3OS
Molecular Weight257.32 g/mol
Exact Mass257.06
IUPAC NameN-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide
SMILESCC(=O)Nc1ccc(-c2cn3ccsc3n2)cc1
InChIInChI=1S/C13H11N3OS/c1-9(17)14-11-4-2-10(3-5-11)12-8-16-6-7-18-13(16)15-12/h2-8H,1H3,(H,14,17)
InChIKeyJKOILEIYPNJUGJ-UHFFFAOYSA-N
XLogP3.02
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.32
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide?
The IUPAC name of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide (CID 685797) is N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide.
What is the SMILES notation for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide?
The canonical SMILES for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide is CC(=O)Nc1ccc(-c2cn3ccsc3n2)cc1.
What is the InChIKey of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide?
The InChIKey is JKOILEIYPNJUGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3OS/c1-9(17)14-11-4-2-10(3-5-11)12-8-16-6-7-18-13(16)15-12/h2-8H,1H3,(H,14,17).
What are the key properties of N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide?
N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide has a molecular weight of 257.32 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazo[2,1-b][1,3]thiazol-6-ylphenyl)acetamide is sourced from PubChem (CID 685797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).