5-ethylthieno[3,4-b]pyrazine

C8H8N2S — CID 118549385

IUPAC5-ethylthieno[3,4-b]pyrazine
SMILESCCc1scc2nccnc12
InChIInChI=1S/C8H8N2S/c1-2-7-8-6(5-11-7)9-3-4-10-8/h3-5H,2H2,1H3
InChIKeyPNFICONFHMGAHH-UHFFFAOYSA-N
MW164.23 g/mol
LogP2.25
Rot. Bonds1

About 5-ethylthieno[3,4-b]pyrazine

5-ethylthieno[3,4-b]pyrazine (PubChem CID 118549385) has the molecular formula C8H8N2S and a molecular weight of 164.23 g/mol. Its IUPAC name is 5-ethylthieno[3,4-b]pyrazine.

Molecular Properties

Compound Name5-ethylthieno[3,4-b]pyrazine
PubChem CID118549385
Molecular FormulaC8H8N2S
Molecular Weight164.23 g/mol
Exact Mass164.04
IUPAC Name5-ethylthieno[3,4-b]pyrazine
SMILESCCc1scc2nccnc12
InChIInChI=1S/C8H8N2S/c1-2-7-8-6(5-11-7)9-3-4-10-8/h3-5H,2H2,1H3
InChIKeyPNFICONFHMGAHH-UHFFFAOYSA-N
XLogP2.25
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.23
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethylthieno[3,4-b]pyrazine?
The IUPAC name of 5-ethylthieno[3,4-b]pyrazine (CID 118549385) is 5-ethylthieno[3,4-b]pyrazine.
What is the SMILES notation for 5-ethylthieno[3,4-b]pyrazine?
The canonical SMILES for 5-ethylthieno[3,4-b]pyrazine is CCc1scc2nccnc12.
What is the InChIKey of 5-ethylthieno[3,4-b]pyrazine?
The InChIKey is PNFICONFHMGAHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2S/c1-2-7-8-6(5-11-7)9-3-4-10-8/h3-5H,2H2,1H3.
What are the key properties of 5-ethylthieno[3,4-b]pyrazine?
5-ethylthieno[3,4-b]pyrazine has a molecular weight of 164.23 g/mol, XLogP of 2.25, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylthieno[3,4-b]pyrazine is sourced from PubChem (CID 118549385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).