2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine

C13H9N5 — CID 141116052

IUPAC2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine
SMILESc1ccc(-c2ccnc(-c3cnccn3)n2)nc1
InChIInChI=1S/C13H9N5/c1-2-5-15-10(3-1)11-4-6-17-13(18-11)12-9-14-7-8-16-12/h1-9H
InChIKeyJVZJKOXEDYWUKK-UHFFFAOYSA-N
MW235.25 g/mol
LogP2.00
Rot. Bonds2

About 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine

2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine (PubChem CID 141116052) has the molecular formula C13H9N5 and a molecular weight of 235.25 g/mol. Its IUPAC name is 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine.

Molecular Properties

Compound Name2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine
PubChem CID141116052
Molecular FormulaC13H9N5
Molecular Weight235.25 g/mol
Exact Mass235.09
IUPAC Name2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine
SMILESc1ccc(-c2ccnc(-c3cnccn3)n2)nc1
InChIInChI=1S/C13H9N5/c1-2-5-15-10(3-1)11-4-6-17-13(18-11)12-9-14-7-8-16-12/h1-9H
InChIKeyJVZJKOXEDYWUKK-UHFFFAOYSA-N
XLogP2.00
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-pyrazin-2-yl-6-pyridin-2-ylpyrazine
CID 174709673
pyrrolo[3,2-b]azepine
CID 66934182
2-(2-pyridin-2-ylphenyl)pyrazine
CID 91494990
iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine
CID 175253430
2-(2-methoxyphenyl)-4-pyrazin-2-ylpyrimidine
CID 174393307
2-[4-(2-methylphenyl)-6-pyridin-2-yl-2-pyridinyl]pyrazine
CID 102074639
5-pyrazin-2-yl-2-pyridin-2-yl-4-pyridin-3-ylpyrimidine
CID 4604268
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113

Frequently Asked Questions

What is the IUPAC name of 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine?
The IUPAC name of 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine (CID 141116052) is 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine.
What is the SMILES notation for 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine?
The canonical SMILES for 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine is c1ccc(-c2ccnc(-c3cnccn3)n2)nc1.
What is the InChIKey of 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine?
The InChIKey is JVZJKOXEDYWUKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N5/c1-2-5-15-10(3-1)11-4-6-17-13(18-11)12-9-14-7-8-16-12/h1-9H.
What are the key properties of 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine?
2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine has a molecular weight of 235.25 g/mol, XLogP of 2.00, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine is sourced from PubChem (CID 141116052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).