3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine

C12H10N2OS2 — CID 127034695

IUPAC3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine
SMILESCCOc1snc2cc(-c3ccsc3)cnc12
InChIInChI=1S/C12H10N2OS2/c1-2-15-12-11-10(14-17-12)5-9(6-13-11)8-3-4-16-7-8/h3-7H,2H2,1H3
InChIKeyVMHOWQQDTZXPSV-UHFFFAOYSA-N
MW262.36 g/mol
LogP3.82
Rot. Bonds3

About 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine

3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine (PubChem CID 127034695) has the molecular formula C12H10N2OS2 and a molecular weight of 262.36 g/mol. Its IUPAC name is 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine.

Molecular Properties

Compound Name3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine
PubChem CID127034695
Molecular FormulaC12H10N2OS2
Molecular Weight262.36 g/mol
Exact Mass262.02
IUPAC Name3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine
SMILESCCOc1snc2cc(-c3ccsc3)cnc12
InChIInChI=1S/C12H10N2OS2/c1-2-15-12-11-10(14-17-12)5-9(6-13-11)8-3-4-16-7-8/h3-7H,2H2,1H3
InChIKeyVMHOWQQDTZXPSV-UHFFFAOYSA-N
XLogP3.82
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine?
The IUPAC name of 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine (CID 127034695) is 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine.
What is the SMILES notation for 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine?
The canonical SMILES for 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine is CCOc1snc2cc(-c3ccsc3)cnc12.
What is the InChIKey of 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine?
The InChIKey is VMHOWQQDTZXPSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2OS2/c1-2-15-12-11-10(14-17-12)5-9(6-13-11)8-3-4-16-7-8/h3-7H,2H2,1H3.
What are the key properties of 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine?
3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine has a molecular weight of 262.36 g/mol, XLogP of 3.82, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-6-thiophen-3-yl-[1,2]thiazolo[4,3-b]pyridine is sourced from PubChem (CID 127034695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).