di(pyrazin-2-yl)diazene

C8H6N6 — CID 101239422

IUPACdi(pyrazin-2-yl)diazene
SMILESc1cnc(/N=N/c2cnccn2)cn1
InChIInChI=1S/C8H6N6/c1-3-11-7(5-9-1)13-14-8-6-10-2-4-12-8/h1-6H/b14-13+
InChIKeyQHAVOQCFQRKXBG-BUHFOSPRSA-N
MW186.18 g/mol
LogP1.68
Rot. Bonds2

About di(pyrazin-2-yl)diazene

di(pyrazin-2-yl)diazene (PubChem CID 101239422) has the molecular formula C8H6N6 and a molecular weight of 186.18 g/mol. Its IUPAC name is di(pyrazin-2-yl)diazene.

Molecular Properties

Compound Namedi(pyrazin-2-yl)diazene
PubChem CID101239422
Molecular FormulaC8H6N6
Molecular Weight186.18 g/mol
Exact Mass186.07
IUPAC Namedi(pyrazin-2-yl)diazene
SMILESc1cnc(/N=N/c2cnccn2)cn1
InChIInChI=1S/C8H6N6/c1-3-11-7(5-9-1)13-14-8-6-10-2-4-12-8/h1-6H/b14-13+
InChIKeyQHAVOQCFQRKXBG-BUHFOSPRSA-N
XLogP1.68
TPSA76.28 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.18
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of di(pyrazin-2-yl)diazene?
The IUPAC name of di(pyrazin-2-yl)diazene (CID 101239422) is di(pyrazin-2-yl)diazene.
What is the SMILES notation for di(pyrazin-2-yl)diazene?
The canonical SMILES for di(pyrazin-2-yl)diazene is c1cnc(/N=N/c2cnccn2)cn1.
What is the InChIKey of di(pyrazin-2-yl)diazene?
The InChIKey is QHAVOQCFQRKXBG-BUHFOSPRSA-N. The full InChI is InChI=1S/C8H6N6/c1-3-11-7(5-9-1)13-14-8-6-10-2-4-12-8/h1-6H/b14-13+.
What are the key properties of di(pyrazin-2-yl)diazene?
di(pyrazin-2-yl)diazene has a molecular weight of 186.18 g/mol, XLogP of 1.68, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for di(pyrazin-2-yl)diazene is sourced from PubChem (CID 101239422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).