3-ethylpyrazin-2-amine

C6H9N3 — CID 18704782

IUPAC3-ethylpyrazin-2-amine
SMILESCCc1nccnc1N
InChIInChI=1S/C6H9N3/c1-2-5-6(7)9-4-3-8-5/h3-4H,2H2,1H3,(H2,7,9)
InChIKeyRFYCVSAKGBHBFO-UHFFFAOYSA-N
MW123.16 g/mol
LogP0.62
Rot. Bonds1

About 3-ethylpyrazin-2-amine

3-ethylpyrazin-2-amine (PubChem CID 18704782) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is 3-ethylpyrazin-2-amine.

Molecular Properties

Compound Name3-ethylpyrazin-2-amine
PubChem CID18704782
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC Name3-ethylpyrazin-2-amine
SMILESCCc1nccnc1N
InChIInChI=1S/C6H9N3/c1-2-5-6(7)9-4-3-8-5/h3-4H,2H2,1H3,(H2,7,9)
InChIKeyRFYCVSAKGBHBFO-UHFFFAOYSA-N
XLogP0.62
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethylpyrazin-2-amine?
The IUPAC name of 3-ethylpyrazin-2-amine (CID 18704782) is 3-ethylpyrazin-2-amine.
What is the SMILES notation for 3-ethylpyrazin-2-amine?
The canonical SMILES for 3-ethylpyrazin-2-amine is CCc1nccnc1N.
What is the InChIKey of 3-ethylpyrazin-2-amine?
The InChIKey is RFYCVSAKGBHBFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c1-2-5-6(7)9-4-3-8-5/h3-4H,2H2,1H3,(H2,7,9).
What are the key properties of 3-ethylpyrazin-2-amine?
3-ethylpyrazin-2-amine has a molecular weight of 123.16 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylpyrazin-2-amine is sourced from PubChem (CID 18704782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).