N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

C15H14FN3OS — CID 2998495

IUPACN-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESO=C(Cc1cn2ccsc2n1)NCCc1ccc(F)cc1
InChIInChI=1S/C15H14FN3OS/c16-12-3-1-11(2-4-12)5-6-17-14(20)9-13-10-19-7-8-21-15(19)18-13/h1-4,7-8,10H,5-6,9H2,(H,17,20)
InChIKeyWYXFJIWRAOTKDY-UHFFFAOYSA-N
MW303.36 g/mol
LogP2.44
Rot. Bonds5

About N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide

N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (PubChem CID 2998495) has the molecular formula C15H14FN3OS and a molecular weight of 303.36 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
PubChem CID2998495
Molecular FormulaC15H14FN3OS
Molecular Weight303.36 g/mol
Exact Mass303.08
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
SMILESO=C(Cc1cn2ccsc2n1)NCCc1ccc(F)cc1
InChIInChI=1S/C15H14FN3OS/c16-12-3-1-11(2-4-12)5-6-17-14(20)9-13-10-19-7-8-21-15(19)18-13/h1-4,7-8,10H,5-6,9H2,(H,17,20)
InChIKeyWYXFJIWRAOTKDY-UHFFFAOYSA-N
XLogP2.44
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide (CID 2998495) is N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is O=C(Cc1cn2ccsc2n1)NCCc1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
The InChIKey is WYXFJIWRAOTKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3OS/c16-12-3-1-11(2-4-12)5-6-17-14(20)9-13-10-19-7-8-21-15(19)18-13/h1-4,7-8,10H,5-6,9H2,(H,17,20).
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide?
N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide has a molecular weight of 303.36 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide is sourced from PubChem (CID 2998495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).