pyrazine-2,6-diamine

C4H6N4 — CID 534688

IUPACpyrazine-2,6-diamine
SMILESNc1cncc(N)n1
InChIInChI=1S/C4H6N4/c5-3-1-7-2-4(6)8-3/h1-2H,(H4,5,6,8)
InChIKeyGYRUCENCQMAGLO-UHFFFAOYSA-N
MW110.12 g/mol
LogP-0.36
Rot. Bonds

About pyrazine-2,6-diamine

pyrazine-2,6-diamine (PubChem CID 534688) has the molecular formula C4H6N4 and a molecular weight of 110.12 g/mol. Its IUPAC name is pyrazine-2,6-diamine.

Molecular Properties

Compound Namepyrazine-2,6-diamine
PubChem CID534688
Molecular FormulaC4H6N4
Molecular Weight110.12 g/mol
Exact Mass110.06
IUPAC Namepyrazine-2,6-diamine
SMILESNc1cncc(N)n1
InChIInChI=1S/C4H6N4/c5-3-1-7-2-4(6)8-3/h1-2H,(H4,5,6,8)
InChIKeyGYRUCENCQMAGLO-UHFFFAOYSA-N
XLogP-0.36
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.12
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of pyrazine-2,6-diamine?
The IUPAC name of pyrazine-2,6-diamine (CID 534688) is pyrazine-2,6-diamine.
What is the SMILES notation for pyrazine-2,6-diamine?
The canonical SMILES for pyrazine-2,6-diamine is Nc1cncc(N)n1.
What is the InChIKey of pyrazine-2,6-diamine?
The InChIKey is GYRUCENCQMAGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N4/c5-3-1-7-2-4(6)8-3/h1-2H,(H4,5,6,8).
What are the key properties of pyrazine-2,6-diamine?
pyrazine-2,6-diamine has a molecular weight of 110.12 g/mol, XLogP of -0.36, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazine-2,6-diamine is sourced from PubChem (CID 534688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).