6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole

C14H13FN2S — CID 112680452

IUPAC6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole
SMILESCc1sc2nc(-c3ccccc3F)c(C)n2c1C
InChIInChI=1S/C14H13FN2S/c1-8-10(3)18-14-16-13(9(2)17(8)14)11-6-4-5-7-12(11)15/h4-7H,1-3H3
InChIKeyNXPBKSJVLLKHGU-UHFFFAOYSA-N
MW260.34 g/mol
LogP4.13
Rot. Bonds1

About 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole

6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole (PubChem CID 112680452) has the molecular formula C14H13FN2S and a molecular weight of 260.34 g/mol. Its IUPAC name is 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole
PubChem CID112680452
Molecular FormulaC14H13FN2S
Molecular Weight260.34 g/mol
Exact Mass260.08
IUPAC Name6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole
SMILESCc1sc2nc(-c3ccccc3F)c(C)n2c1C
InChIInChI=1S/C14H13FN2S/c1-8-10(3)18-14-16-13(9(2)17(8)14)11-6-4-5-7-12(11)15/h4-7H,1-3H3
InChIKeyNXPBKSJVLLKHGU-UHFFFAOYSA-N
XLogP4.13
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole (CID 112680452) is 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole is Cc1sc2nc(-c3ccccc3F)c(C)n2c1C.
What is the InChIKey of 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole?
The InChIKey is NXPBKSJVLLKHGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2S/c1-8-10(3)18-14-16-13(9(2)17(8)14)11-6-4-5-7-12(11)15/h4-7H,1-3H3.
What are the key properties of 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole?
6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole has a molecular weight of 260.34 g/mol, XLogP of 4.13, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluorophenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 112680452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).