2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline

C20H15N3 — CID 123785489

IUPAC2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline
SMILESCc1ccccc1-c1cc(-c2cnc3ccccc3n2)ccn1
InChIInChI=1S/C20H15N3/c1-14-6-2-3-7-16(14)19-12-15(10-11-21-19)20-13-22-17-8-4-5-9-18(17)23-20/h2-13H,1H3
InChIKeyALZOBVJHBMIJDV-UHFFFAOYSA-N
MW297.36 g/mol
LogP4.67
Rot. Bonds2

About 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline

2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline (PubChem CID 123785489) has the molecular formula C20H15N3 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline.

Molecular Properties

Compound Name2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline
PubChem CID123785489
Molecular FormulaC20H15N3
Molecular Weight297.36 g/mol
Exact Mass297.13
IUPAC Name2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline
SMILESCc1ccccc1-c1cc(-c2cnc3ccccc3n2)ccn1
InChIInChI=1S/C20H15N3/c1-14-6-2-3-7-16(14)19-12-15(10-11-21-19)20-13-22-17-8-4-5-9-18(17)23-20/h2-13H,1H3
InChIKeyALZOBVJHBMIJDV-UHFFFAOYSA-N
XLogP4.67
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline?
The IUPAC name of 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline (CID 123785489) is 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline.
What is the SMILES notation for 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline?
The canonical SMILES for 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline is Cc1ccccc1-c1cc(-c2cnc3ccccc3n2)ccn1.
What is the InChIKey of 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline?
The InChIKey is ALZOBVJHBMIJDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3/c1-14-6-2-3-7-16(14)19-12-15(10-11-21-19)20-13-22-17-8-4-5-9-18(17)23-20/h2-13H,1H3.
What are the key properties of 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline?
2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline has a molecular weight of 297.36 g/mol, XLogP of 4.67, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methylphenyl)-4-pyridinyl]quinoxaline is sourced from PubChem (CID 123785489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).