5-anthracen-1-yl-2-pyridin-2-ylpyridine

C24H16N2 — CID 58813785

IUPAC5-anthracen-1-yl-2-pyridin-2-ylpyridine
SMILESc1ccc(-c2ccc(-c3cccc4cc5ccccc5cc34)cn2)nc1
InChIInChI=1S/C24H16N2/c1-2-7-18-15-22-19(14-17(18)6-1)8-5-9-21(22)20-11-12-24(26-16-20)23-10-3-4-13-25-23/h1-16H
InChIKeyUUXXKRDXGGCYIY-UHFFFAOYSA-N
MW332.41 g/mol
LogP6.12
Rot. Bonds2

About 5-anthracen-1-yl-2-pyridin-2-ylpyridine

5-anthracen-1-yl-2-pyridin-2-ylpyridine (PubChem CID 58813785) has the molecular formula C24H16N2 and a molecular weight of 332.41 g/mol. Its IUPAC name is 5-anthracen-1-yl-2-pyridin-2-ylpyridine.

Molecular Properties

Compound Name5-anthracen-1-yl-2-pyridin-2-ylpyridine
PubChem CID58813785
Molecular FormulaC24H16N2
Molecular Weight332.41 g/mol
Exact Mass332.13
IUPAC Name5-anthracen-1-yl-2-pyridin-2-ylpyridine
SMILESc1ccc(-c2ccc(-c3cccc4cc5ccccc5cc34)cn2)nc1
InChIInChI=1S/C24H16N2/c1-2-7-18-15-22-19(14-17(18)6-1)8-5-9-21(22)20-11-12-24(26-16-20)23-10-3-4-13-25-23/h1-16H
InChIKeyUUXXKRDXGGCYIY-UHFFFAOYSA-N
XLogP6.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.41
LogP ≤ 56.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-[6-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]-2-pyridin-2-ylpyridine
CID 163823578
2-[4-[4-[6-(4-naphthalen-1-yl-6-pyridin-2-yl-2-pyridinyl)-3-pyridinyl]phenyl]phenyl]-4,6-diphenylpyrimidine
CID 164816946
4-[2-(2-phenanthren-9-ylphenyl)phenyl]-2,6-dipyridin-2-ylpyridine
CID 166685007
2,4-dinaphthalen-1-yl-6-[3-phenanthren-9-yl-5-(6-pyridin-2-yl-3-pyridinyl)phenyl]-1,3,5-triazine
CID 122416044
5-[2-methyl-5-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-2-pyridin-2-ylpyridine
CID 88554780
5-[4-[10-(6-methylnaphthalen-2-yl)anthracen-9-yl]naphthalen-1-yl]-2-pyridin-2-ylpyridine
CID 88551889
2-(1-pyridin-2-ylanthracen-2-yl)pyridine
CID 19367617
2-phenyl-5-[2-[3-[2-(6-phenyl-3-pyridinyl)phenyl]-5-[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]pyridine
CID 122487708
2,6-dipyridin-2-yl-4-[4-[3-pyridin-2-yl-5-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]pyridine
CID 126730919
5-[2-[3,5-bis[2-(2-bromo-4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-2-pyridin-2-ylpyridine
CID 153434741
5-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-2-[3-(4-phenylphenyl)phenyl]pyridine
CID 153458177
4-[4-[2-[4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]-2,6-dipyridin-2-ylpyridine
CID 122364716

Frequently Asked Questions

What is the IUPAC name of 5-anthracen-1-yl-2-pyridin-2-ylpyridine?
The IUPAC name of 5-anthracen-1-yl-2-pyridin-2-ylpyridine (CID 58813785) is 5-anthracen-1-yl-2-pyridin-2-ylpyridine.
What is the SMILES notation for 5-anthracen-1-yl-2-pyridin-2-ylpyridine?
The canonical SMILES for 5-anthracen-1-yl-2-pyridin-2-ylpyridine is c1ccc(-c2ccc(-c3cccc4cc5ccccc5cc34)cn2)nc1.
What is the InChIKey of 5-anthracen-1-yl-2-pyridin-2-ylpyridine?
The InChIKey is UUXXKRDXGGCYIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N2/c1-2-7-18-15-22-19(14-17(18)6-1)8-5-9-21(22)20-11-12-24(26-16-20)23-10-3-4-13-25-23/h1-16H.
What are the key properties of 5-anthracen-1-yl-2-pyridin-2-ylpyridine?
5-anthracen-1-yl-2-pyridin-2-ylpyridine has a molecular weight of 332.41 g/mol, XLogP of 6.12, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-anthracen-1-yl-2-pyridin-2-ylpyridine is sourced from PubChem (CID 58813785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).