2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine

C35H32FN — CID 171438718

IUPAC2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine
SMILESCC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-c1cc(-c2ccccc2)nc(-c2ccc(F)cc2)c1
InChIInChI=1S/C35H32FN/c1-23(2)31-19-28(25-11-7-5-8-12-25)20-32(24(3)4)35(31)29-21-33(26-13-9-6-10-14-26)37-34(22-29)27-15-17-30(36)18-16-27/h5-24H,1-4H3
InChIKeyOUOQXSVNUSWOSK-UHFFFAOYSA-N
MW485.65 g/mol
LogP10.14
Rot. Bonds6

About 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine

2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine (PubChem CID 171438718) has the molecular formula C35H32FN and a molecular weight of 485.65 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine
PubChem CID171438718
Molecular FormulaC35H32FN
Molecular Weight485.65 g/mol
Exact Mass485.25
IUPAC Name2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine
SMILESCC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-c1cc(-c2ccccc2)nc(-c2ccc(F)cc2)c1
InChIInChI=1S/C35H32FN/c1-23(2)31-19-28(25-11-7-5-8-12-25)20-32(24(3)4)35(31)29-21-33(26-13-9-6-10-14-26)37-34(22-29)27-15-17-30(36)18-16-27/h5-24H,1-4H3
InChIKeyOUOQXSVNUSWOSK-UHFFFAOYSA-N
XLogP10.14
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.65
LogP ≤ 510.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine?
The IUPAC name of 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine (CID 171438718) is 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine.
What is the SMILES notation for 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine?
The canonical SMILES for 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine is CC(C)c1cc(-c2ccccc2)cc(C(C)C)c1-c1cc(-c2ccccc2)nc(-c2ccc(F)cc2)c1.
What is the InChIKey of 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine?
The InChIKey is OUOQXSVNUSWOSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H32FN/c1-23(2)31-19-28(25-11-7-5-8-12-25)20-32(24(3)4)35(31)29-21-33(26-13-9-6-10-14-26)37-34(22-29)27-15-17-30(36)18-16-27/h5-24H,1-4H3.
What are the key properties of 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine?
2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine has a molecular weight of 485.65 g/mol, XLogP of 10.14, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-6-phenyl-4-[4-phenyl-2,6-di(propan-2-yl)phenyl]pyridine is sourced from PubChem (CID 171438718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).