2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine

C10H12N2S — CID 11116883

IUPAC2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine
SMILESCC(C)(C)c1nc2ncccc2s1
InChIInChI=1S/C10H12N2S/c1-10(2,3)9-12-8-7(13-9)5-4-6-11-8/h4-6H,1-3H3
InChIKeyOUGZEAGIFJIRQP-UHFFFAOYSA-N
MW192.29 g/mol
LogP2.99
Rot. Bonds

About 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine

2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine (PubChem CID 11116883) has the molecular formula C10H12N2S and a molecular weight of 192.29 g/mol. Its IUPAC name is 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine
PubChem CID11116883
Molecular FormulaC10H12N2S
Molecular Weight192.29 g/mol
Exact Mass192.07
IUPAC Name2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine
SMILESCC(C)(C)c1nc2ncccc2s1
InChIInChI=1S/C10H12N2S/c1-10(2,3)9-12-8-7(13-9)5-4-6-11-8/h4-6H,1-3H3
InChIKeyOUGZEAGIFJIRQP-UHFFFAOYSA-N
XLogP2.99
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.29
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine?
The IUPAC name of 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine (CID 11116883) is 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine.
What is the SMILES notation for 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine?
The canonical SMILES for 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine is CC(C)(C)c1nc2ncccc2s1.
What is the InChIKey of 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine?
The InChIKey is OUGZEAGIFJIRQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2S/c1-10(2,3)9-12-8-7(13-9)5-4-6-11-8/h4-6H,1-3H3.
What are the key properties of 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine?
2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine has a molecular weight of 192.29 g/mol, XLogP of 2.99, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-[1,3]thiazolo[4,5-b]pyridine is sourced from PubChem (CID 11116883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).