2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline

C23H17N3 — CID 67339660

IUPAC2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline
SMILESC1=C2Nc3ccccc3N=C2C=C(c2ccccc2)N1c1ccccc1
InChIInChI=1S/C23H17N3/c1-3-9-17(10-4-1)23-15-21-22(16-26(23)18-11-5-2-6-12-18)25-20-14-8-7-13-19(20)24-21/h1-16,25H
InChIKeyXWANRXKEEGNEPQ-UHFFFAOYSA-N
MW335.41 g/mol
LogP5.59
Rot. Bonds2

About 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline

2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline (PubChem CID 67339660) has the molecular formula C23H17N3 and a molecular weight of 335.41 g/mol. Its IUPAC name is 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline.

Molecular Properties

Compound Name2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline
PubChem CID67339660
Molecular FormulaC23H17N3
Molecular Weight335.41 g/mol
Exact Mass335.14
IUPAC Name2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline
SMILESC1=C2Nc3ccccc3N=C2C=C(c2ccccc2)N1c1ccccc1
InChIInChI=1S/C23H17N3/c1-3-9-17(10-4-1)23-15-21-22(16-26(23)18-11-5-2-6-12-18)25-20-14-8-7-13-19(20)24-21/h1-16,25H
InChIKeyXWANRXKEEGNEPQ-UHFFFAOYSA-N
XLogP5.59
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.41
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline?
The IUPAC name of 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline (CID 67339660) is 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline.
What is the SMILES notation for 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline?
The canonical SMILES for 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline is C1=C2Nc3ccccc3N=C2C=C(c2ccccc2)N1c1ccccc1.
What is the InChIKey of 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline?
The InChIKey is XWANRXKEEGNEPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17N3/c1-3-9-17(10-4-1)23-15-21-22(16-26(23)18-11-5-2-6-12-18)25-20-14-8-7-13-19(20)24-21/h1-16,25H.
What are the key properties of 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline?
2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline has a molecular weight of 335.41 g/mol, XLogP of 5.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenyl-10H-pyrido[3,4-b]quinoxaline is sourced from PubChem (CID 67339660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).