2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline

C22H18N2 — CID 156598567

IUPAC2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline
SMILESC=C(c1ccccc1)N1C=C(c2ccccc2)Nc2ccccc21
InChIInChI=1S/C22H18N2/c1-17(18-10-4-2-5-11-18)24-16-21(19-12-6-3-7-13-19)23-20-14-8-9-15-22(20)24/h2-16,23H,1H2
InChIKeyLQAHTACFOWPPLS-UHFFFAOYSA-N
MW310.40 g/mol
LogP5.59
Rot. Bonds3

About 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline

2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline (PubChem CID 156598567) has the molecular formula C22H18N2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline.

Molecular Properties

Compound Name2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline
PubChem CID156598567
Molecular FormulaC22H18N2
Molecular Weight310.40 g/mol
Exact Mass310.15
IUPAC Name2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline
SMILESC=C(c1ccccc1)N1C=C(c2ccccc2)Nc2ccccc21
InChIInChI=1S/C22H18N2/c1-17(18-10-4-2-5-11-18)24-16-21(19-12-6-3-7-13-19)23-20-14-8-9-15-22(20)24/h2-16,23H,1H2
InChIKeyLQAHTACFOWPPLS-UHFFFAOYSA-N
XLogP5.59
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.40
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline?
The IUPAC name of 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline (CID 156598567) is 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline.
What is the SMILES notation for 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline?
The canonical SMILES for 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline is C=C(c1ccccc1)N1C=C(c2ccccc2)Nc2ccccc21.
What is the InChIKey of 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline?
The InChIKey is LQAHTACFOWPPLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2/c1-17(18-10-4-2-5-11-18)24-16-21(19-12-6-3-7-13-19)23-20-14-8-9-15-22(20)24/h2-16,23H,1H2.
What are the key properties of 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline?
2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline has a molecular weight of 310.40 g/mol, XLogP of 5.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-4-(1-phenylethenyl)-1H-quinoxaline is sourced from PubChem (CID 156598567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).