5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile

C17H9N5 — CID 67751358

IUPAC5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile
SMILESN#Cc1ccc(-c2ccc(-c3cnc(C#N)cn3)cn2)cc1
InChIInChI=1S/C17H9N5/c18-7-12-1-3-13(4-2-12)16-6-5-14(9-21-16)17-11-20-15(8-19)10-22-17/h1-6,9-11H
InChIKeyHZJQXIFCJRUPQA-UHFFFAOYSA-N
MW283.29 g/mol
LogP2.95
Rot. Bonds2

About 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile

5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile (PubChem CID 67751358) has the molecular formula C17H9N5 and a molecular weight of 283.29 g/mol. Its IUPAC name is 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile
PubChem CID67751358
Molecular FormulaC17H9N5
Molecular Weight283.29 g/mol
Exact Mass283.09
IUPAC Name5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile
SMILESN#Cc1ccc(-c2ccc(-c3cnc(C#N)cn3)cn2)cc1
InChIInChI=1S/C17H9N5/c18-7-12-1-3-13(4-2-12)16-6-5-14(9-21-16)17-11-20-15(8-19)10-22-17/h1-6,9-11H
InChIKeyHZJQXIFCJRUPQA-UHFFFAOYSA-N
XLogP2.95
TPSA86.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile?
The IUPAC name of 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile (CID 67751358) is 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile.
What is the SMILES notation for 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile?
The canonical SMILES for 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile is N#Cc1ccc(-c2ccc(-c3cnc(C#N)cn3)cn2)cc1.
What is the InChIKey of 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile?
The InChIKey is HZJQXIFCJRUPQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H9N5/c18-7-12-1-3-13(4-2-12)16-6-5-14(9-21-16)17-11-20-15(8-19)10-22-17/h1-6,9-11H.
What are the key properties of 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile?
5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile has a molecular weight of 283.29 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(4-cyanophenyl)-3-pyridinyl]pyrazine-2-carbonitrile is sourced from PubChem (CID 67751358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).