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

C14H13FN2S — CID 114835274

IUPAC5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole
SMILESCc1nc2sc(C)c(C)n2c1-c1ccccc1F
InChIInChI=1S/C14H13FN2S/c1-8-13(11-6-4-5-7-12(11)15)17-9(2)10(3)18-14(17)16-8/h4-7H,1-3H3
InChIKeyALOHWOSCMXQHGF-UHFFFAOYSA-N
MW260.34 g/mol
LogP4.13
Rot. Bonds1

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

5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole (PubChem CID 114835274) has the molecular formula C14H13FN2S and a molecular weight of 260.34 g/mol. Its IUPAC name is 5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole
PubChem CID114835274
Molecular FormulaC14H13FN2S
Molecular Weight260.34 g/mol
Exact Mass260.08
IUPAC Name5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole
SMILESCc1nc2sc(C)c(C)n2c1-c1ccccc1F
InChIInChI=1S/C14H13FN2S/c1-8-13(11-6-4-5-7-12(11)15)17-9(2)10(3)18-14(17)16-8/h4-7H,1-3H3
InChIKeyALOHWOSCMXQHGF-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 5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole (CID 114835274) is 5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole is Cc1nc2sc(C)c(C)n2c1-c1ccccc1F.
What is the InChIKey of 5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole?
The InChIKey is ALOHWOSCMXQHGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2S/c1-8-13(11-6-4-5-7-12(11)15)17-9(2)10(3)18-14(17)16-8/h4-7H,1-3H3.
What are the key properties of 5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole?
5-(2-fluorophenyl)-2,3,6-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 5-(2-fluorophenyl)-2,3,6-trimethylimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 114835274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).