pyridine;triphenylborane

C23H20BN — CID 10925275

IUPACpyridine;triphenylborane
SMILESc1ccc(B(c2ccccc2)c2ccccc2)cc1.c1ccncc1
InChIInChI=1S/C18H15B.C5H5N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-6-5-3-1/h1-15H;1-5H
InChIKeyWJSXSXUHWBSPEP-UHFFFAOYSA-N
MW321.23 g/mol
LogP3.28
Rot. Bonds3

About pyridine;triphenylborane

pyridine;triphenylborane (PubChem CID 10925275) has the molecular formula C23H20BN and a molecular weight of 321.23 g/mol. Its IUPAC name is pyridine;triphenylborane.

Molecular Properties

Compound Namepyridine;triphenylborane
PubChem CID10925275
Molecular FormulaC23H20BN
Molecular Weight321.23 g/mol
Exact Mass321.17
IUPAC Namepyridine;triphenylborane
SMILESc1ccc(B(c2ccccc2)c2ccccc2)cc1.c1ccncc1
InChIInChI=1S/C18H15B.C5H5N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-6-5-3-1/h1-15H;1-5H
InChIKeyWJSXSXUHWBSPEP-UHFFFAOYSA-N
XLogP3.28
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.23
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze pyridine;triphenylborane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of pyridine;triphenylborane?
The IUPAC name of pyridine;triphenylborane (CID 10925275) is pyridine;triphenylborane.
What is the SMILES notation for pyridine;triphenylborane?
The canonical SMILES for pyridine;triphenylborane is c1ccc(B(c2ccccc2)c2ccccc2)cc1.c1ccncc1.
What is the InChIKey of pyridine;triphenylborane?
The InChIKey is WJSXSXUHWBSPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15B.C5H5N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-4-6-5-3-1/h1-15H;1-5H.
What are the key properties of pyridine;triphenylborane?
pyridine;triphenylborane has a molecular weight of 321.23 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine;triphenylborane is sourced from PubChem (CID 10925275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).