3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine

C40H27N3 — CID 155306751

IUPAC3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine
SMILESc1ccc(-c2nc3ccccn3c2-c2ccc(-c3cc(-c4ccc5ccccc5c4)cc(-c4ccccn4)c3)cc2)cc1
InChIInChI=1S/C40H27N3/c1-2-11-30(12-3-1)39-40(43-23-9-7-15-38(43)42-39)31-19-16-29(17-20-31)34-25-35(27-36(26-34)37-14-6-8-22-41-37)33-21-18-28-10-4-5-13-32(28)24-33/h1-27H
InChIKeyFGLGOIIBKDDWSC-UHFFFAOYSA-N
MW549.68 g/mol
LogP10.22
Rot. Bonds5

About 3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine

3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine (PubChem CID 155306751) has the molecular formula C40H27N3 and a molecular weight of 549.68 g/mol. Its IUPAC name is 3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine
PubChem CID155306751
Molecular FormulaC40H27N3
Molecular Weight549.68 g/mol
Exact Mass549.22
IUPAC Name3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine
SMILESc1ccc(-c2nc3ccccn3c2-c2ccc(-c3cc(-c4ccc5ccccc5c4)cc(-c4ccccn4)c3)cc2)cc1
InChIInChI=1S/C40H27N3/c1-2-11-30(12-3-1)39-40(43-23-9-7-15-38(43)42-39)31-19-16-29(17-20-31)34-25-35(27-36(26-34)37-14-6-8-22-41-37)33-21-18-28-10-4-5-13-32(28)24-33/h1-27H
InChIKeyFGLGOIIBKDDWSC-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

Frequently Asked Questions

What is the IUPAC name of 3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine?
The IUPAC name of 3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine (CID 155306751) is 3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine is c1ccc(-c2nc3ccccn3c2-c2ccc(-c3cc(-c4ccc5ccccc5c4)cc(-c4ccccn4)c3)cc2)cc1.
What is the InChIKey of 3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine?
The InChIKey is FGLGOIIBKDDWSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H27N3/c1-2-11-30(12-3-1)39-40(43-23-9-7-15-38(43)42-39)31-19-16-29(17-20-31)34-25-35(27-36(26-34)37-14-6-8-22-41-37)33-21-18-28-10-4-5-13-32(28)24-33/h1-27H.
What are the key properties of 3-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine?
3-[4-(3-naphthalen-2-yl-5-pyridin-2-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-[4-(3-naphthalen-2-yl-5-pyridin-2-ylphenyl)phenyl]-2-phenylimidazo[1,2-a]pyridine is sourced from PubChem (CID 155306751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).