pyrazine;1,3,5-triazine

C7H7N5 — CID 69369333

IUPACpyrazine;1,3,5-triazine
SMILESc1cnccn1.c1ncncn1
InChIInChI=1S/C4H4N2.C3H3N3/c1-2-6-4-3-5-1;1-4-2-6-3-5-1/h1-4H;1-3H
InChIKeyRJBSJRQEXRGFNV-UHFFFAOYSA-N
MW161.17 g/mol
LogP0.35
Rot. Bonds

About pyrazine;1,3,5-triazine

pyrazine;1,3,5-triazine (PubChem CID 69369333) has the molecular formula C7H7N5 and a molecular weight of 161.17 g/mol. Its IUPAC name is pyrazine;1,3,5-triazine.

Molecular Properties

Compound Namepyrazine;1,3,5-triazine
PubChem CID69369333
Molecular FormulaC7H7N5
Molecular Weight161.17 g/mol
Exact Mass161.07
IUPAC Namepyrazine;1,3,5-triazine
SMILESc1cnccn1.c1ncncn1
InChIInChI=1S/C4H4N2.C3H3N3/c1-2-6-4-3-5-1;1-4-2-6-3-5-1/h1-4H;1-3H
InChIKeyRJBSJRQEXRGFNV-UHFFFAOYSA-N
XLogP0.35
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.17
LogP ≤ 50.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of pyrazine;1,3,5-triazine?
The IUPAC name of pyrazine;1,3,5-triazine (CID 69369333) is pyrazine;1,3,5-triazine.
What is the SMILES notation for pyrazine;1,3,5-triazine?
The canonical SMILES for pyrazine;1,3,5-triazine is c1cnccn1.c1ncncn1.
What is the InChIKey of pyrazine;1,3,5-triazine?
The InChIKey is RJBSJRQEXRGFNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4N2.C3H3N3/c1-2-6-4-3-5-1;1-4-2-6-3-5-1/h1-4H;1-3H.
What are the key properties of pyrazine;1,3,5-triazine?
pyrazine;1,3,5-triazine has a molecular weight of 161.17 g/mol, XLogP of 0.35, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazine;1,3,5-triazine is sourced from PubChem (CID 69369333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).