2-pyrazin-2-ylselanylpyrazine

C8H6N4Se — CID 50918086

IUPAC2-pyrazin-2-ylselanylpyrazine
SMILESc1cnc([Se]c2cnccn2)cn1
InChIInChI=1S/C8H6N4Se/c1-3-11-7(5-9-1)13-8-6-10-2-4-12-8/h1-6H
InChIKeyMJZSQSQEUGFFEA-UHFFFAOYSA-N
MW237.12 g/mol
LogP-1.08
Rot. Bonds2

About 2-pyrazin-2-ylselanylpyrazine

2-pyrazin-2-ylselanylpyrazine (PubChem CID 50918086) has the molecular formula C8H6N4Se and a molecular weight of 237.12 g/mol. Its IUPAC name is 2-pyrazin-2-ylselanylpyrazine.

Molecular Properties

Compound Name2-pyrazin-2-ylselanylpyrazine
PubChem CID50918086
Molecular FormulaC8H6N4Se
Molecular Weight237.12 g/mol
Exact Mass237.98
IUPAC Name2-pyrazin-2-ylselanylpyrazine
SMILESc1cnc([Se]c2cnccn2)cn1
InChIInChI=1S/C8H6N4Se/c1-3-11-7(5-9-1)13-8-6-10-2-4-12-8/h1-6H
InChIKeyMJZSQSQEUGFFEA-UHFFFAOYSA-N
XLogP-1.08
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.12
LogP ≤ 5-1.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

tris(2-pyrazin-2-ylpyrazine);ruthenium(1+)
CID 138986841
2-methoxypyrazine
CID 70888136
CID 162237215
CID 162237215
2-(2-pyrazin-2-ylethynyl)pyrazine
CID 90277956
2-chloropyrazine;trihydrochloride
CID 175594254
di(pyrazin-2-yl)diazene
CID 101239422
pyrazin-2-amine;pyrazine
CID 161386116
2-bromopyrazine;hydrobromide
CID 166604153
1-pyrazin-2-ylethylphosphane
CID 59073972
ethane;pyrazine-2-carbaldehyde
CID 145021385
1,1-dimethyl-2-pyrazin-2-ylhydrazine
CID 83025719
CID 20677091
CID 20677091

Frequently Asked Questions

What is the IUPAC name of 2-pyrazin-2-ylselanylpyrazine?
The IUPAC name of 2-pyrazin-2-ylselanylpyrazine (CID 50918086) is 2-pyrazin-2-ylselanylpyrazine.
What is the SMILES notation for 2-pyrazin-2-ylselanylpyrazine?
The canonical SMILES for 2-pyrazin-2-ylselanylpyrazine is c1cnc([Se]c2cnccn2)cn1.
What is the InChIKey of 2-pyrazin-2-ylselanylpyrazine?
The InChIKey is MJZSQSQEUGFFEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N4Se/c1-3-11-7(5-9-1)13-8-6-10-2-4-12-8/h1-6H.
What are the key properties of 2-pyrazin-2-ylselanylpyrazine?
2-pyrazin-2-ylselanylpyrazine has a molecular weight of 237.12 g/mol, XLogP of -1.08, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazin-2-ylselanylpyrazine is sourced from PubChem (CID 50918086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).