2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine

C12H16N2S — CID 59820187

IUPAC2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine
SMILESCC(C)c1cnc2nc(C(C)C)sc2c1
InChIInChI=1S/C12H16N2S/c1-7(2)9-5-10-11(13-6-9)14-12(15-10)8(3)4/h5-8H,1-4H3
InChIKeyQTOYWKORZBANEX-UHFFFAOYSA-N
MW220.34 g/mol
LogP3.94
Rot. Bonds2

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

2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine (PubChem CID 59820187) has the molecular formula C12H16N2S and a molecular weight of 220.34 g/mol. Its IUPAC name is 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine
PubChem CID59820187
Molecular FormulaC12H16N2S
Molecular Weight220.34 g/mol
Exact Mass220.10
IUPAC Name2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine
SMILESCC(C)c1cnc2nc(C(C)C)sc2c1
InChIInChI=1S/C12H16N2S/c1-7(2)9-5-10-11(13-6-9)14-12(15-10)8(3)4/h5-8H,1-4H3
InChIKeyQTOYWKORZBANEX-UHFFFAOYSA-N
XLogP3.94
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine 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 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine?
The IUPAC name of 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine (CID 59820187) is 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine.
What is the SMILES notation for 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine?
The canonical SMILES for 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine is CC(C)c1cnc2nc(C(C)C)sc2c1.
What is the InChIKey of 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine?
The InChIKey is QTOYWKORZBANEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2S/c1-7(2)9-5-10-11(13-6-9)14-12(15-10)8(3)4/h5-8H,1-4H3.
What are the key properties of 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine?
2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine has a molecular weight of 220.34 g/mol, XLogP of 3.94, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine is sourced from PubChem (CID 59820187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).