2,3-dihydropyrazine-2,3-dicarbonitrile

C6H4N4 — CID 70541357

IUPAC2,3-dihydropyrazine-2,3-dicarbonitrile
SMILESN#CC1N=CC=NC1C#N
InChIInChI=1S/C6H4N4/c7-3-5-6(4-8)10-2-1-9-5/h1-2,5-6H
InChIKeyASQJSSKHMAMBLG-UHFFFAOYSA-N
MW132.13 g/mol
LogP-0.07
Rot. Bonds

About 2,3-dihydropyrazine-2,3-dicarbonitrile

2,3-dihydropyrazine-2,3-dicarbonitrile (PubChem CID 70541357) has the molecular formula C6H4N4 and a molecular weight of 132.13 g/mol. Its IUPAC name is 2,3-dihydropyrazine-2,3-dicarbonitrile.

Molecular Properties

Compound Name2,3-dihydropyrazine-2,3-dicarbonitrile
PubChem CID70541357
Molecular FormulaC6H4N4
Molecular Weight132.13 g/mol
Exact Mass132.04
IUPAC Name2,3-dihydropyrazine-2,3-dicarbonitrile
SMILESN#CC1N=CC=NC1C#N
InChIInChI=1S/C6H4N4/c7-3-5-6(4-8)10-2-1-9-5/h1-2,5-6H
InChIKeyASQJSSKHMAMBLG-UHFFFAOYSA-N
XLogP-0.07
TPSA72.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.13
LogP ≤ 5-0.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydropyrazine-2,3-dicarbonitrile?
The IUPAC name of 2,3-dihydropyrazine-2,3-dicarbonitrile (CID 70541357) is 2,3-dihydropyrazine-2,3-dicarbonitrile.
What is the SMILES notation for 2,3-dihydropyrazine-2,3-dicarbonitrile?
The canonical SMILES for 2,3-dihydropyrazine-2,3-dicarbonitrile is N#CC1N=CC=NC1C#N.
What is the InChIKey of 2,3-dihydropyrazine-2,3-dicarbonitrile?
The InChIKey is ASQJSSKHMAMBLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4N4/c7-3-5-6(4-8)10-2-1-9-5/h1-2,5-6H.
What are the key properties of 2,3-dihydropyrazine-2,3-dicarbonitrile?
2,3-dihydropyrazine-2,3-dicarbonitrile has a molecular weight of 132.13 g/mol, XLogP of -0.07, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydropyrazine-2,3-dicarbonitrile is sourced from PubChem (CID 70541357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).