2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine

C44H28N2 — CID 90361806

IUPAC2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine
SMILESc1ccc(-c2cccc(-c3ccc4c(-c5cccc6ccccc56)c5ccccc5c(-c5cccc6ccccc56)c4c3)n2)nc1
InChIInChI=1S/C44H28N2/c1-3-16-32-29(12-1)14-9-20-34(32)43-36-18-5-6-19-37(36)44(35-21-10-15-30-13-2-4-17-33(30)35)39-28-31(25-26-38(39)43)40-23-11-24-42(46-40)41-22-7-8-27-45-41/h1-28H
InChIKeyFPKIQJQMUFRPQY-UHFFFAOYSA-N
MW584.72 g/mol
LogP11.76
Rot. Bonds4

About 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine

2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine (PubChem CID 90361806) has the molecular formula C44H28N2 and a molecular weight of 584.72 g/mol. Its IUPAC name is 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine.

Molecular Properties

Compound Name2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine
PubChem CID90361806
Molecular FormulaC44H28N2
Molecular Weight584.72 g/mol
Exact Mass584.23
IUPAC Name2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine
SMILESc1ccc(-c2cccc(-c3ccc4c(-c5cccc6ccccc56)c5ccccc5c(-c5cccc6ccccc56)c4c3)n2)nc1
InChIInChI=1S/C44H28N2/c1-3-16-32-29(12-1)14-9-20-34(32)43-36-18-5-6-19-37(36)44(35-21-10-15-30-13-2-4-17-33(30)35)39-28-31(25-26-38(39)43)40-23-11-24-42(46-40)41-22-7-8-27-45-41/h1-28H
InChIKeyFPKIQJQMUFRPQY-UHFFFAOYSA-N
XLogP11.76
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500584.72
LogP ≤ 511.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(9,10-diphenylanthracen-2-yl)-6-pyridin-2-ylpyridine
CID 59722108
2-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]pyridine
CID 118487396
2-(6-methyl-9,10-dinaphthalen-1-ylanthracen-2-yl)-6-phenylpyridine
CID 59722146
5-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]-2-pyridin-2-ylpyridine
CID 163823578
2-[10-[2,3-bis(ethenyl)phenyl]-9-naphthalen-1-ylanthracen-2-yl]-6-phenylpyridine
CID 88589712
2-anthracen-2-yl-1,10-phenanthroline;5-anthracen-2-yl-1,10-phenanthroline;2-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-(9,10-diphenylanthracen-2-yl)-1,10-phenanthroline;5-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2,9-dipyridin-2-yl-1,10-phenanthroline;2-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline;5-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)-1,10-phenanthroline
CID 159482909
2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-6-phenylpyridine
CID 121338692
4-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)-N-(4-pyridin-2-ylphenyl)anilino]benzonitrile
CID 90336207
9-naphthalen-1-yl-2-(9-naphthalen-1-yl-10-phenylanthracen-2-yl)-10-phenylanthracene
CID 59557553
9,10-dinaphthalen-1-yl-2-(2-phenylphenyl)anthracene
CID 58875728
2,6-bis(4-methylphenyl)-9,10-dinaphthalen-1-ylanthracene
CID 59766352
2-[4-(1,4,5,8-tetradeuterio-10-naphthalen-1-ylanthracen-9-yl)phenyl]pyridine
CID 176646872

Frequently Asked Questions

What is the IUPAC name of 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine?
The IUPAC name of 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine (CID 90361806) is 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine.
What is the SMILES notation for 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine?
The canonical SMILES for 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine is c1ccc(-c2cccc(-c3ccc4c(-c5cccc6ccccc56)c5ccccc5c(-c5cccc6ccccc56)c4c3)n2)nc1.
What is the InChIKey of 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine?
The InChIKey is FPKIQJQMUFRPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28N2/c1-3-16-32-29(12-1)14-9-20-34(32)43-36-18-5-6-19-37(36)44(35-21-10-15-30-13-2-4-17-33(30)35)39-28-31(25-26-38(39)43)40-23-11-24-42(46-40)41-22-7-8-27-45-41/h1-28H.
What are the key properties of 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine?
2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine has a molecular weight of 584.72 g/mol, XLogP of 11.76, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9,10-dinaphthalen-1-ylanthracen-2-yl)-6-pyridin-2-ylpyridine is sourced from PubChem (CID 90361806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).