2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine

C11H10N2S — CID 138718793

IUPAC2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine
SMILESC=Cc1cnc2nc(C3CC3)sc2c1
InChIInChI=1S/C11H10N2S/c1-2-7-5-9-10(12-6-7)13-11(14-9)8-3-4-8/h2,5-6,8H,1,3-4H2
InChIKeyIMTYAAKTRIKSEJ-UHFFFAOYSA-N
MW202.28 g/mol
LogP3.21
Rot. Bonds2

About 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine

2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine (PubChem CID 138718793) has the molecular formula C11H10N2S and a molecular weight of 202.28 g/mol. Its IUPAC name is 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine
PubChem CID138718793
Molecular FormulaC11H10N2S
Molecular Weight202.28 g/mol
Exact Mass202.06
IUPAC Name2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine
SMILESC=Cc1cnc2nc(C3CC3)sc2c1
InChIInChI=1S/C11H10N2S/c1-2-7-5-9-10(12-6-7)13-11(14-9)8-3-4-8/h2,5-6,8H,1,3-4H2
InChIKeyIMTYAAKTRIKSEJ-UHFFFAOYSA-N
XLogP3.21
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.28
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine?
The IUPAC name of 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine (CID 138718793) is 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine.
What is the SMILES notation for 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine?
The canonical SMILES for 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine is C=Cc1cnc2nc(C3CC3)sc2c1.
What is the InChIKey of 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine?
The InChIKey is IMTYAAKTRIKSEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2S/c1-2-7-5-9-10(12-6-7)13-11(14-9)8-3-4-8/h2,5-6,8H,1,3-4H2.
What are the key properties of 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine?
2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine has a molecular weight of 202.28 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine is sourced from PubChem (CID 138718793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).