3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine

C40H27N3 — CID 155306901

IUPAC3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine
SMILESc1ccc(-c2nc3ccccn3c2-c2cccc(-c3cc(-c4cccnc4)cc(-c4ccc5ccccc5c4)c3)c2)cc1
InChIInChI=1S/C40H27N3/c1-2-11-29(12-3-1)39-40(43-21-7-6-17-38(43)42-39)33-15-8-14-31(23-33)35-24-36(26-37(25-35)34-16-9-20-41-27-34)32-19-18-28-10-4-5-13-30(28)22-32/h1-27H
InChIKeyLYCMRLBZVYSCPB-UHFFFAOYSA-N
MW549.68 g/mol
LogP10.22
Rot. Bonds5

About 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine

3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine (PubChem CID 155306901) has the molecular formula C40H27N3 and a molecular weight of 549.68 g/mol. Its IUPAC name is 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine
PubChem CID155306901
Molecular FormulaC40H27N3
Molecular Weight549.68 g/mol
Exact Mass549.22
IUPAC Name3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine
SMILESc1ccc(-c2nc3ccccn3c2-c2cccc(-c3cc(-c4cccnc4)cc(-c4ccc5ccccc5c4)c3)c2)cc1
InChIInChI=1S/C40H27N3/c1-2-11-29(12-3-1)39-40(43-21-7-6-17-38(43)42-39)33-15-8-14-31(23-33)35-24-36(26-37(25-35)34-16-9-20-41-27-34)32-19-18-28-10-4-5-13-30(28)22-32/h1-27H
InChIKeyLYCMRLBZVYSCPB-UHFFFAOYSA-N
XLogP10.22
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500549.68
LogP ≤ 510.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine
CID 155306751
3-[4-[3,5-bis[4-(2-naphthalen-2-ylimidazo[1,2-a]pyridin-3-yl)phenyl]phenyl]phenyl]-2-naphthalen-2-ylimidazo[1,2-a]pyridine
CID 131846664
2-naphthalen-2-yl-3-[4-(2-naphthalen-2-ylimidazo[1,2-a]pyridin-3-yl)phenyl]imidazo[1,2-a]pyridine
CID 59999905
3-[3-[3-(2,6-dimethyl-3-pyridinyl)-5-naphthalen-2-ylphenyl]phenyl]-2-phenylimidazo[1,2-a]pyridine
CID 164781014
2-(4-fluorophenyl)-3-[3-(4-fluorophenyl)phenyl]imidazo[1,2-a]pyridine
CID 71699551
2-(4-phenylphenyl)-3-[3-[4-phenyl-6-[3-[2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]phenyl]-2-pyridinyl]phenyl]imidazo[1,2-a]pyridine
CID 164781069
2-naphthalen-2-yl-4-(4-phenylphenyl)-6-[4-(3-pyridin-3-ylphenyl)phenyl]-1,3,5-triazine
CID 146587202
2-phenyl-3-[3-[3-phenyl-5-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]phenyl]quinoxaline
CID 164781299
2-phenyl-3-[3-[2-phenyl-6-[3-(2-phenylimidazo[1,2-a]pyridin-3-yl)phenyl]pyrimidin-4-yl]phenyl]imidazo[1,2-a]pyridine
CID 155306963
bis(3-[4-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]-2-naphthalen-2-ylimidazo[1,2-a]pyridine);3-[4-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]-2-phenylimidazo[1,2-a]pyridine
CID 159888199
2-phenyl-3-[3-[3-phenyl-5-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]phenyl]quinoxaline;2-phenyl-3-[4-[3-phenyl-5-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]phenyl]quinoxaline;2-phenyl-3-[3-phenyl-5-[4-(3-phenylimidazo[1,2-a]pyridin-2-yl)phenyl]phenyl]quinoxaline
CID 164994147
3-phenyl-2-[3-[3-phenyl-5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]imidazo[1,2-a]pyridine
CID 164781284

Frequently Asked Questions

What is the IUPAC name of 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine?
The IUPAC name of 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine (CID 155306901) is 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine is c1ccc(-c2nc3ccccn3c2-c2cccc(-c3cc(-c4cccnc4)cc(-c4ccc5ccccc5c4)c3)c2)cc1.
What is the InChIKey of 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine?
The InChIKey is LYCMRLBZVYSCPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H27N3/c1-2-11-29(12-3-1)39-40(43-21-7-6-17-38(43)42-39)33-15-8-14-31(23-33)35-24-36(26-37(25-35)34-16-9-20-41-27-34)32-19-18-28-10-4-5-13-30(28)22-32/h1-27H.
What are the key properties of 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine?
3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine has a molecular weight of 549.68 g/mol, XLogP of 10.22, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(3-naphthalen-2-yl-5-pyridin-3-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine is sourced from PubChem (CID 155306901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).