2,4-diphenyl-6-triphenylen-2-ylpyridine

C35H23N — CID 118490712

IUPAC2,4-diphenyl-6-triphenylen-2-ylpyridine
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5ccccc5c4c3)c2)cc1
InChIInChI=1S/C35H23N/c1-3-11-24(12-4-1)27-22-34(25-13-5-2-6-14-25)36-35(23-27)26-19-20-32-30-17-8-7-15-28(30)29-16-9-10-18-31(29)33(32)21-26/h1-23H
InChIKeyUPEXOABQBBLNOE-UHFFFAOYSA-N
MW457.58 g/mol
LogP9.54
Rot. Bonds3

About 2,4-diphenyl-6-triphenylen-2-ylpyridine

2,4-diphenyl-6-triphenylen-2-ylpyridine (PubChem CID 118490712) has the molecular formula C35H23N and a molecular weight of 457.58 g/mol. Its IUPAC name is 2,4-diphenyl-6-triphenylen-2-ylpyridine.

Molecular Properties

Compound Name2,4-diphenyl-6-triphenylen-2-ylpyridine
PubChem CID118490712
Molecular FormulaC35H23N
Molecular Weight457.58 g/mol
Exact Mass457.18
IUPAC Name2,4-diphenyl-6-triphenylen-2-ylpyridine
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5ccccc5c4c3)c2)cc1
InChIInChI=1S/C35H23N/c1-3-11-24(12-4-1)27-22-34(25-13-5-2-6-14-25)36-35(23-27)26-19-20-32-30-17-8-7-15-28(30)29-16-9-10-18-31(29)33(32)21-26/h1-23H
InChIKeyUPEXOABQBBLNOE-UHFFFAOYSA-N
XLogP9.54
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500457.58
LogP ≤ 59.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

2,6-diphenyl-4-[4-(3-triphenylen-2-ylphenyl)phenyl]pyridine
CID 139518099
2-naphthalen-2-yl-6-phenyl-4-(3-phenyl-5-triphenylen-2-ylphenyl)pyridine
CID 130355484
2,6-diphenyl-4-[4-(12-phenylchrysen-6-yl)phenyl]pyridine
CID 155655416
6-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-2,4-di(triphenylen-2-yl)benzo[h]quinoline
CID 89137414
4-[3,5-bis(4-phenylphenyl)phenyl]-2,6-diphenylpyridine
CID 58943272
2,4-diphenyl-6-[4-[3-phenyl-5-(4-phenylphenyl)phenyl]phenyl]pyridine
CID 58943632
2-[4-[3-(3,5-diphenylphenyl)-5-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]-4,6-diphenylpyridine
CID 58943331
2-(3-phenanthren-9-yl-5-triphenylen-2-ylphenyl)-4,6-bis(4-phenylphenyl)pyridine
CID 176622498
2-phenyl-4,6-bis[3-phenyl-5-(4-phenylphenyl)phenyl]pyridine
CID 121311684
4-[3-(2,6-diphenyl-4-pyridinyl)-5-phenylphenyl]-2,6-diphenylpyridine
CID 59428704
4,6-bis(3-phenylphenyl)-2-(3-triphenylen-2-ylphenyl)pyrimidine
CID 137389671
bis(4-[4-[3-[4-[2,6-bis(4-phenylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-2,6-bis(4-phenylphenyl)pyridine);2-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-4,6-diphenylpyridine;4-[4-[4-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-2,6-diphenylpyridine
CID 161135007

Frequently Asked Questions

What is the IUPAC name of 2,4-diphenyl-6-triphenylen-2-ylpyridine?
The IUPAC name of 2,4-diphenyl-6-triphenylen-2-ylpyridine (CID 118490712) is 2,4-diphenyl-6-triphenylen-2-ylpyridine.
What is the SMILES notation for 2,4-diphenyl-6-triphenylen-2-ylpyridine?
The canonical SMILES for 2,4-diphenyl-6-triphenylen-2-ylpyridine is c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4c5ccccc5c5ccccc5c4c3)c2)cc1.
What is the InChIKey of 2,4-diphenyl-6-triphenylen-2-ylpyridine?
The InChIKey is UPEXOABQBBLNOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H23N/c1-3-11-24(12-4-1)27-22-34(25-13-5-2-6-14-25)36-35(23-27)26-19-20-32-30-17-8-7-15-28(30)29-16-9-10-18-31(29)33(32)21-26/h1-23H.
What are the key properties of 2,4-diphenyl-6-triphenylen-2-ylpyridine?
2,4-diphenyl-6-triphenylen-2-ylpyridine has a molecular weight of 457.58 g/mol, XLogP of 9.54, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diphenyl-6-triphenylen-2-ylpyridine is sourced from PubChem (CID 118490712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).