2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine

C26H23N — CID 140599873

IUPAC2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine
SMILESCC(C)c1ccc(-c2ccnc(-c3ccc(-c4ccccc4)cc3)c2)cc1
InChIInChI=1S/C26H23N/c1-19(2)20-8-10-23(11-9-20)25-16-17-27-26(18-25)24-14-12-22(13-15-24)21-6-4-3-5-7-21/h3-19H,1-2H3
InChIKeyNCRLMNKKWZPMTD-UHFFFAOYSA-N
MW349.48 g/mol
LogP7.21
Rot. Bonds4

About 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine

2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine (PubChem CID 140599873) has the molecular formula C26H23N and a molecular weight of 349.48 g/mol. Its IUPAC name is 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine.

Molecular Properties

Compound Name2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine
PubChem CID140599873
Molecular FormulaC26H23N
Molecular Weight349.48 g/mol
Exact Mass349.18
IUPAC Name2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine
SMILESCC(C)c1ccc(-c2ccnc(-c3ccc(-c4ccccc4)cc3)c2)cc1
InChIInChI=1S/C26H23N/c1-19(2)20-8-10-23(11-9-20)25-16-17-27-26(18-25)24-14-12-22(13-15-24)21-6-4-3-5-7-21/h3-19H,1-2H3
InChIKeyNCRLMNKKWZPMTD-UHFFFAOYSA-N
XLogP7.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.48
LogP ≤ 57.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine?
The IUPAC name of 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine (CID 140599873) is 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine.
What is the SMILES notation for 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine?
The canonical SMILES for 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine is CC(C)c1ccc(-c2ccnc(-c3ccc(-c4ccccc4)cc3)c2)cc1.
What is the InChIKey of 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine?
The InChIKey is NCRLMNKKWZPMTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N/c1-19(2)20-8-10-23(11-9-20)25-16-17-27-26(18-25)24-14-12-22(13-15-24)21-6-4-3-5-7-21/h3-19H,1-2H3.
What are the key properties of 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine?
2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine has a molecular weight of 349.48 g/mol, XLogP of 7.21, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenylphenyl)-4-(4-propan-2-ylphenyl)pyridine is sourced from PubChem (CID 140599873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).