2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline

C25H22N2 — CID 142288460

IUPAC2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline
SMILESC=CC1=C(/C=C\C)N(c2ccccc2)c2ccccc2N1c1ccccc1
InChIInChI=1S/C25H22N2/c1-3-13-23-22(4-2)26(20-14-7-5-8-15-20)24-18-11-12-19-25(24)27(23)21-16-9-6-10-17-21/h3-19H,2H2,1H3/b13-3-
InChIKeyHYRLPEUADGWJTG-DXNYSGJVSA-N
MW350.47 g/mol
LogP6.95
Rot. Bonds4

About 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline

2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline (PubChem CID 142288460) has the molecular formula C25H22N2 and a molecular weight of 350.47 g/mol. Its IUPAC name is 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline.

Molecular Properties

Compound Name2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline
PubChem CID142288460
Molecular FormulaC25H22N2
Molecular Weight350.47 g/mol
Exact Mass350.18
IUPAC Name2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline
SMILESC=CC1=C(/C=C\C)N(c2ccccc2)c2ccccc2N1c1ccccc1
InChIInChI=1S/C25H22N2/c1-3-13-23-22(4-2)26(20-14-7-5-8-15-20)24-18-11-12-19-25(24)27(23)21-16-9-6-10-17-21/h3-19H,2H2,1H3/b13-3-
InChIKeyHYRLPEUADGWJTG-DXNYSGJVSA-N
XLogP6.95
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.47
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline?
The IUPAC name of 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline (CID 142288460) is 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline.
What is the SMILES notation for 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline?
The canonical SMILES for 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline is C=CC1=C(/C=C\C)N(c2ccccc2)c2ccccc2N1c1ccccc1.
What is the InChIKey of 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline?
The InChIKey is HYRLPEUADGWJTG-DXNYSGJVSA-N. The full InChI is InChI=1S/C25H22N2/c1-3-13-23-22(4-2)26(20-14-7-5-8-15-20)24-18-11-12-19-25(24)27(23)21-16-9-6-10-17-21/h3-19H,2H2,1H3/b13-3-.
What are the key properties of 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline?
2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline has a molecular weight of 350.47 g/mol, XLogP of 6.95, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1,4-diphenyl-3-[(Z)-prop-1-enyl]quinoxaline is sourced from PubChem (CID 142288460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).