6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine

C9H9FN2S — CID 118410775

IUPAC6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine
SMILESCC(C)c1nc2scnc2cc1F
InChIInChI=1S/C9H9FN2S/c1-5(2)8-6(10)3-7-9(12-8)13-4-11-7/h3-5H,1-2H3
InChIKeyRGIFQTUHIQMRON-UHFFFAOYSA-N
MW196.25 g/mol
LogP2.95
Rot. Bonds1

About 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine

6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine (PubChem CID 118410775) has the molecular formula C9H9FN2S and a molecular weight of 196.25 g/mol. Its IUPAC name is 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine.

Molecular Properties

Compound Name6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine
PubChem CID118410775
Molecular FormulaC9H9FN2S
Molecular Weight196.25 g/mol
Exact Mass196.05
IUPAC Name6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine
SMILESCC(C)c1nc2scnc2cc1F
InChIInChI=1S/C9H9FN2S/c1-5(2)8-6(10)3-7-9(12-8)13-4-11-7/h3-5H,1-2H3
InChIKeyRGIFQTUHIQMRON-UHFFFAOYSA-N
XLogP2.95
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine?
The IUPAC name of 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine (CID 118410775) is 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine.
What is the SMILES notation for 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine?
The canonical SMILES for 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine is CC(C)c1nc2scnc2cc1F.
What is the InChIKey of 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine?
The InChIKey is RGIFQTUHIQMRON-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN2S/c1-5(2)8-6(10)3-7-9(12-8)13-4-11-7/h3-5H,1-2H3.
What are the key properties of 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine?
6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine has a molecular weight of 196.25 g/mol, XLogP of 2.95, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-5-propan-2-yl-[1,3]thiazolo[5,4-b]pyridine is sourced from PubChem (CID 118410775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).