3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine

C21H15N3 — CID 59724442

IUPAC3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine
SMILESc1ccc(-c2cncc(-c3ccc(-c4ccccn4)nc3)c2)cc1
InChIInChI=1S/C21H15N3/c1-2-6-16(7-3-1)18-12-19(14-22-13-18)17-9-10-21(24-15-17)20-8-4-5-11-23-20/h1-15H
InChIKeyQERQVUQAFGVBGB-UHFFFAOYSA-N
MW309.37 g/mol
LogP4.87
Rot. Bonds3

About 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine

3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine (PubChem CID 59724442) has the molecular formula C21H15N3 and a molecular weight of 309.37 g/mol. Its IUPAC name is 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine.

Molecular Properties

Compound Name3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine
PubChem CID59724442
Molecular FormulaC21H15N3
Molecular Weight309.37 g/mol
Exact Mass309.13
IUPAC Name3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine
SMILESc1ccc(-c2cncc(-c3ccc(-c4ccccn4)nc3)c2)cc1
InChIInChI=1S/C21H15N3/c1-2-6-16(7-3-1)18-12-19(14-22-13-18)17-9-10-21(24-15-17)20-8-4-5-11-23-20/h1-15H
InChIKeyQERQVUQAFGVBGB-UHFFFAOYSA-N
XLogP4.87
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine?
The IUPAC name of 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine (CID 59724442) is 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine.
What is the SMILES notation for 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine?
The canonical SMILES for 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine is c1ccc(-c2cncc(-c3ccc(-c4ccccn4)nc3)c2)cc1.
What is the InChIKey of 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine?
The InChIKey is QERQVUQAFGVBGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15N3/c1-2-6-16(7-3-1)18-12-19(14-22-13-18)17-9-10-21(24-15-17)20-8-4-5-11-23-20/h1-15H.
What are the key properties of 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine?
3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine has a molecular weight of 309.37 g/mol, XLogP of 4.87, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-5-(6-pyridin-2-yl-3-pyridinyl)pyridine is sourced from PubChem (CID 59724442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).