[2-(2-pyridin-2-ylphenyl)phenyl]boronic acid

C17H14BNO2 — CID 175560830

IUPAC[2-(2-pyridin-2-ylphenyl)phenyl]boronic acid
SMILESOB(O)c1ccccc1-c1ccccc1-c1ccccn1
InChIInChI=1S/C17H14BNO2/c20-18(21)16-10-4-3-8-14(16)13-7-1-2-9-15(13)17-11-5-6-12-19-17/h1-12,20-21H
InChIKeyRINXEKKOZNRPFW-UHFFFAOYSA-N
MW275.12 g/mol
LogP2.10
Rot. Bonds3

About [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid

[2-(2-pyridin-2-ylphenyl)phenyl]boronic acid (PubChem CID 175560830) has the molecular formula C17H14BNO2 and a molecular weight of 275.12 g/mol. Its IUPAC name is [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid.

Molecular Properties

Compound Name[2-(2-pyridin-2-ylphenyl)phenyl]boronic acid
PubChem CID175560830
Molecular FormulaC17H14BNO2
Molecular Weight275.12 g/mol
Exact Mass275.11
IUPAC Name[2-(2-pyridin-2-ylphenyl)phenyl]boronic acid
SMILESOB(O)c1ccccc1-c1ccccc1-c1ccccn1
InChIInChI=1S/C17H14BNO2/c20-18(21)16-10-4-3-8-14(16)13-7-1-2-9-15(13)17-11-5-6-12-19-17/h1-12,20-21H
InChIKeyRINXEKKOZNRPFW-UHFFFAOYSA-N
XLogP2.10
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.12
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(2-bromophenyl)boronic acid;2-(2-bromophenyl)pyridine;2-bromopyridine
CID 160893517
2,6-bis(2-pyridin-2-ylphenyl)phenol
CID 175876654
2-(2-methylphenyl)pyridine
CID 144596153
2-pyridin-2-ylphenol;hydrate
CID 175244966
cesium 2,6-dipyridin-2-ylphenolate
CID 59522981
bis(dimethylazanide);bis(2-pyridin-2-ylphenol);titanium(2+)
CID 135489220
CID 158478788
CID 158478788
2-(2-pyridin-2-ylphenyl)pyrazine
CID 91494990
(2-pyridin-2-ylphenyl) selenohypobromite
CID 102165047
(2-cyclopenta[b][1,4]thiazin-2-ylphenyl)boronic acid
CID 141289408
2-[2-[2-(2-pyridin-2-ylphenyl)ethenyl]phenyl]pyridine
CID 154584408
2-(2,5-dimethyl-4-pyridin-2-ylphenyl)pyridine
CID 118652406

Frequently Asked Questions

What is the IUPAC name of [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid?
The IUPAC name of [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid (CID 175560830) is [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid.
What is the SMILES notation for [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid?
The canonical SMILES for [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid is OB(O)c1ccccc1-c1ccccc1-c1ccccn1.
What is the InChIKey of [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid?
The InChIKey is RINXEKKOZNRPFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14BNO2/c20-18(21)16-10-4-3-8-14(16)13-7-1-2-9-15(13)17-11-5-6-12-19-17/h1-12,20-21H.
What are the key properties of [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid?
[2-(2-pyridin-2-ylphenyl)phenyl]boronic acid has a molecular weight of 275.12 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-pyridin-2-ylphenyl)phenyl]boronic acid is sourced from PubChem (CID 175560830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).