3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine

C26H19N3 — CID 166918238

IUPAC3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine
SMILESc1ccc(-c2ccc(Nc3nc4ccccc4nc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C26H19N3/c1-3-9-19(10-4-1)20-15-17-22(18-16-20)27-26-25(21-11-5-2-6-12-21)28-23-13-7-8-14-24(23)29-26/h1-18H,(H,27,29)
InChIKeyBHZCOIPKSDKWGJ-UHFFFAOYSA-N
MW373.46 g/mol
LogP6.71
Rot. Bonds4

About 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine

3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine (PubChem CID 166918238) has the molecular formula C26H19N3 and a molecular weight of 373.46 g/mol. Its IUPAC name is 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine.

Molecular Properties

Compound Name3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine
PubChem CID166918238
Molecular FormulaC26H19N3
Molecular Weight373.46 g/mol
Exact Mass373.16
IUPAC Name3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine
SMILESc1ccc(-c2ccc(Nc3nc4ccccc4nc3-c3ccccc3)cc2)cc1
InChIInChI=1S/C26H19N3/c1-3-9-19(10-4-1)20-15-17-22(18-16-20)27-26-25(21-11-5-2-6-12-21)28-23-13-7-8-14-24(23)29-26/h1-18H,(H,27,29)
InChIKeyBHZCOIPKSDKWGJ-UHFFFAOYSA-N
XLogP6.71
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500373.46
LogP ≤ 56.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-4-[4-(N-[4-(3-phenylquinoxalin-2-yl)phenyl]anilino)phenyl]aniline
CID 70898532
2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(4-phenylphenyl)quinoxaline
CID 156561648
2-N,4-N,6-N-tris[4-[4-(4-phenylphenyl)phenyl]phenyl]-1,3,5-triazine-2,4,6-triamine
CID 146533849
4-phenyl-N-(4-phenylphenyl)-N-[4-[3-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]quinoxalin-2-yl]phenyl]aniline
CID 58370929
2-phenyl-3-(3-phenylphenyl)quinoxaline
CID 175058958
3-N-(4-methylphenyl)quinoxaline-2,3-diamine
CID 102985247
N-(4-methylphenyl)phenanthridin-6-amine
CID 156902145
3-chloro-N-[4-(2-phenyl-1,3-thiazol-4-yl)phenyl]quinoxalin-2-amine
CID 108772125
1-[[3-(4-methylphenyl)quinoxalin-2-yl]amino]-3-phenylthiourea
CID 2331057
1-[4-[3-(3,5-dimethoxyanilino)quinoxalin-2-yl]phenyl]ethanone
CID 68882323
(2R,3R,5E)-5-[(3-phenylquinoxalin-2-yl)hydrazinylidene]pentane-1,2,3,4-tetrol
CID 139229642
2-N-(4-anilinophenyl)-3-N-phenylsulfanylquinoxaline-2,3-diamine
CID 143442867

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine?
The IUPAC name of 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine (CID 166918238) is 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine.
What is the SMILES notation for 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine?
The canonical SMILES for 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine is c1ccc(-c2ccc(Nc3nc4ccccc4nc3-c3ccccc3)cc2)cc1.
What is the InChIKey of 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine?
The InChIKey is BHZCOIPKSDKWGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H19N3/c1-3-9-19(10-4-1)20-15-17-22(18-16-20)27-26-25(21-11-5-2-6-12-21)28-23-13-7-8-14-24(23)29-26/h1-18H,(H,27,29).
What are the key properties of 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine?
3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine has a molecular weight of 373.46 g/mol, XLogP of 6.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-N-(4-phenylphenyl)quinoxalin-2-amine is sourced from PubChem (CID 166918238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).