7-bromo-3-ethylpyrido[2,3-b]pyrazine

C9H8BrN3 — CID 175916445

IUPAC7-bromo-3-ethylpyrido[2,3-b]pyrazine
SMILESCCc1cnc2cc(Br)cnc2n1
InChIInChI=1S/C9H8BrN3/c1-2-7-5-11-8-3-6(10)4-12-9(8)13-7/h3-5H,2H2,1H3
InChIKeyWNFGGNMJYVQNIQ-UHFFFAOYSA-N
MW238.09 g/mol
LogP2.35
Rot. Bonds1

About 7-bromo-3-ethylpyrido[2,3-b]pyrazine

7-bromo-3-ethylpyrido[2,3-b]pyrazine (PubChem CID 175916445) has the molecular formula C9H8BrN3 and a molecular weight of 238.09 g/mol. Its IUPAC name is 7-bromo-3-ethylpyrido[2,3-b]pyrazine.

Molecular Properties

Compound Name7-bromo-3-ethylpyrido[2,3-b]pyrazine
PubChem CID175916445
Molecular FormulaC9H8BrN3
Molecular Weight238.09 g/mol
Exact Mass236.99
IUPAC Name7-bromo-3-ethylpyrido[2,3-b]pyrazine
SMILESCCc1cnc2cc(Br)cnc2n1
InChIInChI=1S/C9H8BrN3/c1-2-7-5-11-8-3-6(10)4-12-9(8)13-7/h3-5H,2H2,1H3
InChIKeyWNFGGNMJYVQNIQ-UHFFFAOYSA-N
XLogP2.35
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.09
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-3-ethylpyrido[2,3-b]pyrazine?
The IUPAC name of 7-bromo-3-ethylpyrido[2,3-b]pyrazine (CID 175916445) is 7-bromo-3-ethylpyrido[2,3-b]pyrazine.
What is the SMILES notation for 7-bromo-3-ethylpyrido[2,3-b]pyrazine?
The canonical SMILES for 7-bromo-3-ethylpyrido[2,3-b]pyrazine is CCc1cnc2cc(Br)cnc2n1.
What is the InChIKey of 7-bromo-3-ethylpyrido[2,3-b]pyrazine?
The InChIKey is WNFGGNMJYVQNIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrN3/c1-2-7-5-11-8-3-6(10)4-12-9(8)13-7/h3-5H,2H2,1H3.
What are the key properties of 7-bromo-3-ethylpyrido[2,3-b]pyrazine?
7-bromo-3-ethylpyrido[2,3-b]pyrazine has a molecular weight of 238.09 g/mol, XLogP of 2.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-3-ethylpyrido[2,3-b]pyrazine is sourced from PubChem (CID 175916445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).