6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid

C11H6FN3O2S — CID 114080787

IUPAC6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid
SMILESO=C(O)c1cn2cc(-c3cncc(F)c3)nc2s1
InChIInChI=1S/C11H6FN3O2S/c12-7-1-6(2-13-3-7)8-4-15-5-9(10(16)17)18-11(15)14-8/h1-5H,(H,16,17)
InChIKeyDMDPPDRRTDMLFU-UHFFFAOYSA-N
MW263.25 g/mol
LogP2.30
Rot. Bonds2

About 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid

6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid (PubChem CID 114080787) has the molecular formula C11H6FN3O2S and a molecular weight of 263.25 g/mol. Its IUPAC name is 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid.

Molecular Properties

Compound Name6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid
PubChem CID114080787
Molecular FormulaC11H6FN3O2S
Molecular Weight263.25 g/mol
Exact Mass263.02
IUPAC Name6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid
SMILESO=C(O)c1cn2cc(-c3cncc(F)c3)nc2s1
InChIInChI=1S/C11H6FN3O2S/c12-7-1-6(2-13-3-7)8-4-15-5-9(10(16)17)18-11(15)14-8/h1-5H,(H,16,17)
InChIKeyDMDPPDRRTDMLFU-UHFFFAOYSA-N
XLogP2.30
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.25
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid?
The IUPAC name of 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid (CID 114080787) is 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid.
What is the SMILES notation for 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid?
The canonical SMILES for 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid is O=C(O)c1cn2cc(-c3cncc(F)c3)nc2s1.
What is the InChIKey of 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid?
The InChIKey is DMDPPDRRTDMLFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6FN3O2S/c12-7-1-6(2-13-3-7)8-4-15-5-9(10(16)17)18-11(15)14-8/h1-5H,(H,16,17).
What are the key properties of 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid?
6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid has a molecular weight of 263.25 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-fluoro-3-pyridinyl)imidazo[2,1-b][1,3]thiazole-2-carboxylic acid is sourced from PubChem (CID 114080787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).