4-phenyl-1H-quinoxaline

C14H12N2 — CID 174916009

IUPAC4-phenyl-1H-quinoxaline
SMILESC1=CN(c2ccccc2)c2ccccc2N1
InChIInChI=1S/C14H12N2/c1-2-6-12(7-3-1)16-11-10-15-13-8-4-5-9-14(13)16/h1-11,15H
InChIKeyIMDOWBVAJUZPMX-UHFFFAOYSA-N
MW208.26 g/mol
LogP3.72
Rot. Bonds1

About 4-phenyl-1H-quinoxaline

4-phenyl-1H-quinoxaline (PubChem CID 174916009) has the molecular formula C14H12N2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-phenyl-1H-quinoxaline.

Molecular Properties

Compound Name4-phenyl-1H-quinoxaline
PubChem CID174916009
Molecular FormulaC14H12N2
Molecular Weight208.26 g/mol
Exact Mass208.10
IUPAC Name4-phenyl-1H-quinoxaline
SMILESC1=CN(c2ccccc2)c2ccccc2N1
InChIInChI=1S/C14H12N2/c1-2-6-12(7-3-1)16-11-10-15-13-8-4-5-9-14(13)16/h1-11,15H
InChIKeyIMDOWBVAJUZPMX-UHFFFAOYSA-N
XLogP3.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-phenyl-1H-quinoxaline?
The IUPAC name of 4-phenyl-1H-quinoxaline (CID 174916009) is 4-phenyl-1H-quinoxaline.
What is the SMILES notation for 4-phenyl-1H-quinoxaline?
The canonical SMILES for 4-phenyl-1H-quinoxaline is C1=CN(c2ccccc2)c2ccccc2N1.
What is the InChIKey of 4-phenyl-1H-quinoxaline?
The InChIKey is IMDOWBVAJUZPMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2/c1-2-6-12(7-3-1)16-11-10-15-13-8-4-5-9-14(13)16/h1-11,15H.
What are the key properties of 4-phenyl-1H-quinoxaline?
4-phenyl-1H-quinoxaline has a molecular weight of 208.26 g/mol, XLogP of 3.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1H-quinoxaline is sourced from PubChem (CID 174916009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).