2-[2,6-bis(3-bromophenyl)phenyl]pyridine

C23H15Br2N — CID 135012000

IUPAC2-[2,6-bis(3-bromophenyl)phenyl]pyridine
SMILESBrc1cccc(-c2cccc(-c3cccc(Br)c3)c2-c2ccccn2)c1
InChIInChI=1S/C23H15Br2N/c24-18-8-3-6-16(14-18)20-10-5-11-21(17-7-4-9-19(25)15-17)23(20)22-12-1-2-13-26-22/h1-15H
InChIKeySQOMIADNAUAMHU-UHFFFAOYSA-N
MW465.19 g/mol
LogP7.61
Rot. Bonds3

About 2-[2,6-bis(3-bromophenyl)phenyl]pyridine

2-[2,6-bis(3-bromophenyl)phenyl]pyridine (PubChem CID 135012000) has the molecular formula C23H15Br2N and a molecular weight of 465.19 g/mol. Its IUPAC name is 2-[2,6-bis(3-bromophenyl)phenyl]pyridine.

Molecular Properties

Compound Name2-[2,6-bis(3-bromophenyl)phenyl]pyridine
PubChem CID135012000
Molecular FormulaC23H15Br2N
Molecular Weight465.19 g/mol
Exact Mass462.96
IUPAC Name2-[2,6-bis(3-bromophenyl)phenyl]pyridine
SMILESBrc1cccc(-c2cccc(-c3cccc(Br)c3)c2-c2ccccn2)c1
InChIInChI=1S/C23H15Br2N/c24-18-8-3-6-16(14-18)20-10-5-11-21(17-7-4-9-19(25)15-17)23(20)22-12-1-2-13-26-22/h1-15H
InChIKeySQOMIADNAUAMHU-UHFFFAOYSA-N
XLogP7.61
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500465.19
LogP ≤ 57.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[2,6-bis(3-bromophenyl)phenyl]pyridine?
The IUPAC name of 2-[2,6-bis(3-bromophenyl)phenyl]pyridine (CID 135012000) is 2-[2,6-bis(3-bromophenyl)phenyl]pyridine.
What is the SMILES notation for 2-[2,6-bis(3-bromophenyl)phenyl]pyridine?
The canonical SMILES for 2-[2,6-bis(3-bromophenyl)phenyl]pyridine is Brc1cccc(-c2cccc(-c3cccc(Br)c3)c2-c2ccccn2)c1.
What is the InChIKey of 2-[2,6-bis(3-bromophenyl)phenyl]pyridine?
The InChIKey is SQOMIADNAUAMHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15Br2N/c24-18-8-3-6-16(14-18)20-10-5-11-21(17-7-4-9-19(25)15-17)23(20)22-12-1-2-13-26-22/h1-15H.
What are the key properties of 2-[2,6-bis(3-bromophenyl)phenyl]pyridine?
2-[2,6-bis(3-bromophenyl)phenyl]pyridine has a molecular weight of 465.19 g/mol, XLogP of 7.61, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,6-bis(3-bromophenyl)phenyl]pyridine is sourced from PubChem (CID 135012000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).