3-ethoxypyrazin-2-amine

C6H9N3O — CID 13416935

IUPAC3-ethoxypyrazin-2-amine
SMILESCCOc1nccnc1N
InChIInChI=1S/C6H9N3O/c1-2-10-6-5(7)8-3-4-9-6/h3-4H,2H2,1H3,(H2,7,8)
InChIKeyZULCYKWRRGZJJR-UHFFFAOYSA-N
MW139.16 g/mol
LogP0.46
Rot. Bonds2

About 3-ethoxypyrazin-2-amine

3-ethoxypyrazin-2-amine (PubChem CID 13416935) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is 3-ethoxypyrazin-2-amine.

Molecular Properties

Compound Name3-ethoxypyrazin-2-amine
PubChem CID13416935
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Name3-ethoxypyrazin-2-amine
SMILESCCOc1nccnc1N
InChIInChI=1S/C6H9N3O/c1-2-10-6-5(7)8-3-4-9-6/h3-4H,2H2,1H3,(H2,7,8)
InChIKeyZULCYKWRRGZJJR-UHFFFAOYSA-N
XLogP0.46
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxypyrazin-2-amine?
The IUPAC name of 3-ethoxypyrazin-2-amine (CID 13416935) is 3-ethoxypyrazin-2-amine.
What is the SMILES notation for 3-ethoxypyrazin-2-amine?
The canonical SMILES for 3-ethoxypyrazin-2-amine is CCOc1nccnc1N.
What is the InChIKey of 3-ethoxypyrazin-2-amine?
The InChIKey is ZULCYKWRRGZJJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c1-2-10-6-5(7)8-3-4-9-6/h3-4H,2H2,1H3,(H2,7,8).
What are the key properties of 3-ethoxypyrazin-2-amine?
3-ethoxypyrazin-2-amine has a molecular weight of 139.16 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxypyrazin-2-amine is sourced from PubChem (CID 13416935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).