(5-phenyl-3-pyridinyl)borinic acid

C11H10BNO — CID 143745833

IUPAC(5-phenyl-3-pyridinyl)borinic acid
SMILESOBc1cncc(-c2ccccc2)c1
InChIInChI=1S/C11H10BNO/c14-12-11-6-10(7-13-8-11)9-4-2-1-3-5-9/h1-8,12,14H
InChIKeyQTZDPHJSHZLXCN-UHFFFAOYSA-N
MW183.02 g/mol
LogP0.72
Rot. Bonds2

About (5-phenyl-3-pyridinyl)borinic acid

(5-phenyl-3-pyridinyl)borinic acid (PubChem CID 143745833) has the molecular formula C11H10BNO and a molecular weight of 183.02 g/mol. Its IUPAC name is (5-phenyl-3-pyridinyl)borinic acid.

Molecular Properties

Compound Name(5-phenyl-3-pyridinyl)borinic acid
PubChem CID143745833
Molecular FormulaC11H10BNO
Molecular Weight183.02 g/mol
Exact Mass183.09
IUPAC Name(5-phenyl-3-pyridinyl)borinic acid
SMILESOBc1cncc(-c2ccccc2)c1
InChIInChI=1S/C11H10BNO/c14-12-11-6-10(7-13-8-11)9-4-2-1-3-5-9/h1-8,12,14H
InChIKeyQTZDPHJSHZLXCN-UHFFFAOYSA-N
XLogP0.72
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.02
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (5-phenyl-3-pyridinyl)borinic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-phenylpyridin-3-ol
CID 2762902
3-phenyl-5-[10-(5-phenyl-3-pyridinyl)anthracen-9-yl]pyridine
CID 88908908
5-phenyl-N-(5-phenyl-3-pyridinyl)pyridin-3-amine
CID 146533965
[5-(3-phenylphenyl)-3-pyridinyl]boronic acid
CID 141281758
potassium trifluoro-(5-phenyl-3-pyridinyl)boranuide
CID 135004117
3-[3-[3-[3-phenyl-5-[3-[3-(5-pyridin-3-yl-3-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]-5-pyridin-3-ylpyridine
CID 155116854
3-(5-phenyl-3-pyridinyl)-1,2,4-oxadiazole
CID 69178344
CID 67366174
CID 67366174
3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine
CID 59724442
3-phenyl-5-(1H-pyrazol-5-yl)pyridine
CID 90751414
(1S)-1-(5-phenyl-3-pyridinyl)ethanamine
CID 96702221
3-(3,5-diphenylphenyl)pyridine
CID 141411458

Frequently Asked Questions

What is the IUPAC name of (5-phenyl-3-pyridinyl)borinic acid?
The IUPAC name of (5-phenyl-3-pyridinyl)borinic acid (CID 143745833) is (5-phenyl-3-pyridinyl)borinic acid.
What is the SMILES notation for (5-phenyl-3-pyridinyl)borinic acid?
The canonical SMILES for (5-phenyl-3-pyridinyl)borinic acid is OBc1cncc(-c2ccccc2)c1.
What is the InChIKey of (5-phenyl-3-pyridinyl)borinic acid?
The InChIKey is QTZDPHJSHZLXCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BNO/c14-12-11-6-10(7-13-8-11)9-4-2-1-3-5-9/h1-8,12,14H.
What are the key properties of (5-phenyl-3-pyridinyl)borinic acid?
(5-phenyl-3-pyridinyl)borinic acid has a molecular weight of 183.02 g/mol, XLogP of 0.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-phenyl-3-pyridinyl)borinic acid is sourced from PubChem (CID 143745833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).