2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline

C24H16N8 — CID 71413064

IUPAC2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline
SMILESc1ccc(-c2ccn(-c3nc4ccccc4nc3-n3ccc(-c4ccccn4)n3)n2)nc1
InChIInChI=1S/C24H16N8/c1-2-10-20-19(9-1)27-23(31-15-11-21(29-31)17-7-3-5-13-25-17)24(28-20)32-16-12-22(30-32)18-8-4-6-14-26-18/h1-16H
InChIKeyRBDVTLJMMYGHSD-UHFFFAOYSA-N
MW416.45 g/mol
LogP4.13
Rot. Bonds4

About 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline

2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline (PubChem CID 71413064) has the molecular formula C24H16N8 and a molecular weight of 416.45 g/mol. Its IUPAC name is 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline.

Molecular Properties

Compound Name2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline
PubChem CID71413064
Molecular FormulaC24H16N8
Molecular Weight416.45 g/mol
Exact Mass416.15
IUPAC Name2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline
SMILESc1ccc(-c2ccn(-c3nc4ccccc4nc3-n3ccc(-c4ccccn4)n3)n2)nc1
InChIInChI=1S/C24H16N8/c1-2-10-20-19(9-1)27-23(31-15-11-21(29-31)17-7-3-5-13-25-17)24(28-20)32-16-12-22(30-32)18-8-4-6-14-26-18/h1-16H
InChIKeyRBDVTLJMMYGHSD-UHFFFAOYSA-N
XLogP4.13
TPSA87.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.45
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

4-[2-(3-pyridin-2-ylpyrazol-1-yl)pyrido[3,2-d]pyrimidin-4-yl]morpholine
CID 168922650
ethane;2-(1-methylpyrazol-3-yl)pyridine
CID 145203642
2,3-dipyridin-2-ylquinoxaline;platinum(2+);bis(2-pyridin-2-ylpyridine);ruthenium(2+)
CID 50910408
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
pyrrolo[3,2-b]azepine
CID 66934182
disodium;hydride;2-pyridin-2-ylpyridine
CID 174959125

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline?
The IUPAC name of 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline (CID 71413064) is 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline.
What is the SMILES notation for 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline?
The canonical SMILES for 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline is c1ccc(-c2ccn(-c3nc4ccccc4nc3-n3ccc(-c4ccccn4)n3)n2)nc1.
What is the InChIKey of 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline?
The InChIKey is RBDVTLJMMYGHSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N8/c1-2-10-20-19(9-1)27-23(31-15-11-21(29-31)17-7-3-5-13-25-17)24(28-20)32-16-12-22(30-32)18-8-4-6-14-26-18/h1-16H.
What are the key properties of 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline?
2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline has a molecular weight of 416.45 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(3-pyridin-2-ylpyrazol-1-yl)quinoxaline is sourced from PubChem (CID 71413064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).