2,3-diphenyl-1-pyrazin-2-ylindole

C24H17N3 — CID 53254157

IUPAC2,3-diphenyl-1-pyrazin-2-ylindole
SMILESc1ccc(-c2c(-c3ccccc3)n(-c3cnccn3)c3ccccc23)cc1
InChIInChI=1S/C24H17N3/c1-3-9-18(10-4-1)23-20-13-7-8-14-21(20)27(22-17-25-15-16-26-22)24(23)19-11-5-2-6-12-19/h1-17H
InChIKeyYAGOVKBWGMJNSC-UHFFFAOYSA-N
MW347.42 g/mol
LogP5.75
Rot. Bonds3

About 2,3-diphenyl-1-pyrazin-2-ylindole

2,3-diphenyl-1-pyrazin-2-ylindole (PubChem CID 53254157) has the molecular formula C24H17N3 and a molecular weight of 347.42 g/mol. Its IUPAC name is 2,3-diphenyl-1-pyrazin-2-ylindole.

Molecular Properties

Compound Name2,3-diphenyl-1-pyrazin-2-ylindole
PubChem CID53254157
Molecular FormulaC24H17N3
Molecular Weight347.42 g/mol
Exact Mass347.14
IUPAC Name2,3-diphenyl-1-pyrazin-2-ylindole
SMILESc1ccc(-c2c(-c3ccccc3)n(-c3cnccn3)c3ccccc23)cc1
InChIInChI=1S/C24H17N3/c1-3-9-18(10-4-1)23-20-13-7-8-14-21(20)27(22-17-25-15-16-26-22)24(23)19-11-5-2-6-12-19/h1-17H
InChIKeyYAGOVKBWGMJNSC-UHFFFAOYSA-N
XLogP5.75
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.42
LogP ≤ 55.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-diphenyl-1-pyrazin-2-ylindole?
The IUPAC name of 2,3-diphenyl-1-pyrazin-2-ylindole (CID 53254157) is 2,3-diphenyl-1-pyrazin-2-ylindole.
What is the SMILES notation for 2,3-diphenyl-1-pyrazin-2-ylindole?
The canonical SMILES for 2,3-diphenyl-1-pyrazin-2-ylindole is c1ccc(-c2c(-c3ccccc3)n(-c3cnccn3)c3ccccc23)cc1.
What is the InChIKey of 2,3-diphenyl-1-pyrazin-2-ylindole?
The InChIKey is YAGOVKBWGMJNSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17N3/c1-3-9-18(10-4-1)23-20-13-7-8-14-21(20)27(22-17-25-15-16-26-22)24(23)19-11-5-2-6-12-19/h1-17H.
What are the key properties of 2,3-diphenyl-1-pyrazin-2-ylindole?
2,3-diphenyl-1-pyrazin-2-ylindole has a molecular weight of 347.42 g/mol, XLogP of 5.75, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenyl-1-pyrazin-2-ylindole is sourced from PubChem (CID 53254157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).