5-(2-bromophenyl)-4-methyl-2-phenylpyridine

C18H14BrN — CID 122487761

IUPAC5-(2-bromophenyl)-4-methyl-2-phenylpyridine
SMILESCc1cc(-c2ccccc2)ncc1-c1ccccc1Br
InChIInChI=1S/C18H14BrN/c1-13-11-18(14-7-3-2-4-8-14)20-12-16(13)15-9-5-6-10-17(15)19/h2-12H,1H3
InChIKeyOLOQAOPAXIHHQV-UHFFFAOYSA-N
MW324.22 g/mol
LogP5.49
Rot. Bonds2

About 5-(2-bromophenyl)-4-methyl-2-phenylpyridine

5-(2-bromophenyl)-4-methyl-2-phenylpyridine (PubChem CID 122487761) has the molecular formula C18H14BrN and a molecular weight of 324.22 g/mol. Its IUPAC name is 5-(2-bromophenyl)-4-methyl-2-phenylpyridine.

Molecular Properties

Compound Name5-(2-bromophenyl)-4-methyl-2-phenylpyridine
PubChem CID122487761
Molecular FormulaC18H14BrN
Molecular Weight324.22 g/mol
Exact Mass323.03
IUPAC Name5-(2-bromophenyl)-4-methyl-2-phenylpyridine
SMILESCc1cc(-c2ccccc2)ncc1-c1ccccc1Br
InChIInChI=1S/C18H14BrN/c1-13-11-18(14-7-3-2-4-8-14)20-12-16(13)15-9-5-6-10-17(15)19/h2-12H,1H3
InChIKeyOLOQAOPAXIHHQV-UHFFFAOYSA-N
XLogP5.49
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.22
LogP ≤ 55.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(2-bromophenyl)-4-methyl-2-phenylpyridine?
The IUPAC name of 5-(2-bromophenyl)-4-methyl-2-phenylpyridine (CID 122487761) is 5-(2-bromophenyl)-4-methyl-2-phenylpyridine.
What is the SMILES notation for 5-(2-bromophenyl)-4-methyl-2-phenylpyridine?
The canonical SMILES for 5-(2-bromophenyl)-4-methyl-2-phenylpyridine is Cc1cc(-c2ccccc2)ncc1-c1ccccc1Br.
What is the InChIKey of 5-(2-bromophenyl)-4-methyl-2-phenylpyridine?
The InChIKey is OLOQAOPAXIHHQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14BrN/c1-13-11-18(14-7-3-2-4-8-14)20-12-16(13)15-9-5-6-10-17(15)19/h2-12H,1H3.
What are the key properties of 5-(2-bromophenyl)-4-methyl-2-phenylpyridine?
5-(2-bromophenyl)-4-methyl-2-phenylpyridine has a molecular weight of 324.22 g/mol, XLogP of 5.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-bromophenyl)-4-methyl-2-phenylpyridine is sourced from PubChem (CID 122487761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).