3,6-dimethoxypyrazin-2-amine

C6H9N3O2 — CID 45122049

IUPAC3,6-dimethoxypyrazin-2-amine
SMILESCOc1cnc(OC)c(N)n1
InChIInChI=1S/C6H9N3O2/c1-10-4-3-8-6(11-2)5(7)9-4/h3H,1-2H3,(H2,7,9)
InChIKeyUXMDNQYOWYWTPP-UHFFFAOYSA-N
MW155.16 g/mol
LogP0.08
Rot. Bonds2

About 3,6-dimethoxypyrazin-2-amine

3,6-dimethoxypyrazin-2-amine (PubChem CID 45122049) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is 3,6-dimethoxypyrazin-2-amine.

Molecular Properties

Compound Name3,6-dimethoxypyrazin-2-amine
PubChem CID45122049
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name3,6-dimethoxypyrazin-2-amine
SMILESCOc1cnc(OC)c(N)n1
InChIInChI=1S/C6H9N3O2/c1-10-4-3-8-6(11-2)5(7)9-4/h3H,1-2H3,(H2,7,9)
InChIKeyUXMDNQYOWYWTPP-UHFFFAOYSA-N
XLogP0.08
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3,6-dimethoxypyrazin-2-amine?
The IUPAC name of 3,6-dimethoxypyrazin-2-amine (CID 45122049) is 3,6-dimethoxypyrazin-2-amine.
What is the SMILES notation for 3,6-dimethoxypyrazin-2-amine?
The canonical SMILES for 3,6-dimethoxypyrazin-2-amine is COc1cnc(OC)c(N)n1.
What is the InChIKey of 3,6-dimethoxypyrazin-2-amine?
The InChIKey is UXMDNQYOWYWTPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c1-10-4-3-8-6(11-2)5(7)9-4/h3H,1-2H3,(H2,7,9).
What are the key properties of 3,6-dimethoxypyrazin-2-amine?
3,6-dimethoxypyrazin-2-amine has a molecular weight of 155.16 g/mol, XLogP of 0.08, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethoxypyrazin-2-amine is sourced from PubChem (CID 45122049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).