2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine

C23H18N2 — CID 146224739

IUPAC2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine
SMILESc1ccc(C(c2cccc(-c3ccccn3)c2)c2ccccn2)cc1
InChIInChI=1S/C23H18N2/c1-2-9-18(10-3-1)23(22-14-5-7-16-25-22)20-12-8-11-19(17-20)21-13-4-6-15-24-21/h1-17,23H
InChIKeyJSKDDTMDAZRWDP-UHFFFAOYSA-N
MW322.41 g/mol
LogP5.32
Rot. Bonds4

About 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine

2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine (PubChem CID 146224739) has the molecular formula C23H18N2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine.

Molecular Properties

Compound Name2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine
PubChem CID146224739
Molecular FormulaC23H18N2
Molecular Weight322.41 g/mol
Exact Mass322.15
IUPAC Name2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine
SMILESc1ccc(C(c2cccc(-c3ccccn3)c2)c2ccccn2)cc1
InChIInChI=1S/C23H18N2/c1-2-9-18(10-3-1)23(22-14-5-7-16-25-22)20-12-8-11-19(17-20)21-13-4-6-15-24-21/h1-17,23H
InChIKeyJSKDDTMDAZRWDP-UHFFFAOYSA-N
XLogP5.32
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.41
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine?
The IUPAC name of 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine (CID 146224739) is 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine.
What is the SMILES notation for 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine?
The canonical SMILES for 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine is c1ccc(C(c2cccc(-c3ccccn3)c2)c2ccccn2)cc1.
What is the InChIKey of 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine?
The InChIKey is JSKDDTMDAZRWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2/c1-2-9-18(10-3-1)23(22-14-5-7-16-25-22)20-12-8-11-19(17-20)21-13-4-6-15-24-21/h1-17,23H.
What are the key properties of 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine?
2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine has a molecular weight of 322.41 g/mol, XLogP of 5.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[phenyl(pyridin-2-yl)methyl]phenyl]pyridine is sourced from PubChem (CID 146224739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).