4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine

C43H31N — CID 58151660

IUPAC4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine
SMILESC=Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccccc5)cc4)c3)cc2)cc1
InChIInChI=1S/C43H31N/c1-2-31-13-15-34(16-14-31)37-17-19-38(20-18-37)41-29-42(39-25-21-35(22-26-39)32-9-5-3-6-10-32)44-43(30-41)40-27-23-36(24-28-40)33-11-7-4-8-12-33/h2-30H,1H2
InChIKeyRVWBIPALKKWXFA-UHFFFAOYSA-N
MW561.73 g/mol
LogP11.73
Rot. Bonds7

About 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine

4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine (PubChem CID 58151660) has the molecular formula C43H31N and a molecular weight of 561.73 g/mol. Its IUPAC name is 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine.

Molecular Properties

Compound Name4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine
PubChem CID58151660
Molecular FormulaC43H31N
Molecular Weight561.73 g/mol
Exact Mass561.25
IUPAC Name4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine
SMILESC=Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccccc5)cc4)c3)cc2)cc1
InChIInChI=1S/C43H31N/c1-2-31-13-15-34(16-14-31)37-17-19-38(20-18-37)41-29-42(39-25-21-35(22-26-39)32-9-5-3-6-10-32)44-43(30-41)40-27-23-36(24-28-40)33-11-7-4-8-12-33/h2-30H,1H2
InChIKeyRVWBIPALKKWXFA-UHFFFAOYSA-N
XLogP11.73
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms44
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.73
LogP ≤ 511.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine?
The IUPAC name of 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine (CID 58151660) is 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine.
What is the SMILES notation for 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine?
The canonical SMILES for 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine is C=Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc(-c5ccccc5)cc4)c3)cc2)cc1.
What is the InChIKey of 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine?
The InChIKey is RVWBIPALKKWXFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H31N/c1-2-31-13-15-34(16-14-31)37-17-19-38(20-18-37)41-29-42(39-25-21-35(22-26-39)32-9-5-3-6-10-32)44-43(30-41)40-27-23-36(24-28-40)33-11-7-4-8-12-33/h2-30H,1H2.
What are the key properties of 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine?
4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine has a molecular weight of 561.73 g/mol, XLogP of 11.73, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-ethenylphenyl)phenyl]-2,6-bis(4-phenylphenyl)pyridine is sourced from PubChem (CID 58151660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).