2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine

C56H43FN2 — CID 162085107

IUPAC2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine
SMILESCc1cc(-c2ccccc2-c2cnc(-c3ccccc3)cc2-c2ccc(-c3ccccc3)cc2)cc(-c2ccccc2-c2cnc(-c3ccc(F)cc3)cc2C(C)C)c1
InChIInChI=1S/C56H43FN2/c1-37(2)51-33-55(43-26-28-46(57)29-27-43)58-35-53(51)49-20-12-10-18-47(49)44-30-38(3)31-45(32-44)48-19-11-13-21-50(48)54-36-59-56(42-16-8-5-9-17-42)34-52(54)41-24-22-40(23-25-41)39-14-6-4-7-15-39/h4-37H,1-3H3
InChIKeyAKKOASPQPIYXFP-UHFFFAOYSA-N
MW762.97 g/mol
LogP15.38
Rot. Bonds9

About 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine

2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine (PubChem CID 162085107) has the molecular formula C56H43FN2 and a molecular weight of 762.97 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine
PubChem CID162085107
Molecular FormulaC56H43FN2
Molecular Weight762.97 g/mol
Exact Mass762.34
IUPAC Name2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine
SMILESCc1cc(-c2ccccc2-c2cnc(-c3ccccc3)cc2-c2ccc(-c3ccccc3)cc2)cc(-c2ccccc2-c2cnc(-c3ccc(F)cc3)cc2C(C)C)c1
InChIInChI=1S/C56H43FN2/c1-37(2)51-33-55(43-26-28-46(57)29-27-43)58-35-53(51)49-20-12-10-18-47(49)44-30-38(3)31-45(32-44)48-19-11-13-21-50(48)54-36-59-56(42-16-8-5-9-17-42)34-52(54)41-24-22-40(23-25-41)39-14-6-4-7-15-39/h4-37H,1-3H3
InChIKeyAKKOASPQPIYXFP-UHFFFAOYSA-N
XLogP15.38
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500762.97
LogP ≤ 515.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(4-fluorophenyl)-4-methyl-2-(4-phenylphenyl)pyridine
CID 142322042
5-[2-[3,5-bis[2-(4,6-diphenyl-3-pyridinyl)phenyl]phenyl]phenyl]-4-methyl-2-phenylpyridine
CID 122487855
5-[4-fluoro-2-[3-methyl-5-[1,1,2,2-tetradeuterio-2-(6-phenyl-3-pyridinyl)ethyl]phenyl]phenyl]-2-phenyl-4-(4-phenylphenyl)pyridine
CID 169048456
2-(3,5-dimethylphenyl)-4-phenyl-5-propan-2-ylpyridine
CID 140847625
2-[4-[2-[3-chloro-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine
CID 134225954
2-[5-[2-[3-[2-[6-(2,4-difluorophenyl)-3-pyridinyl]-5-fluorophenyl]-5-[5-fluoro-2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]-4-fluorophenyl]-2-pyridinyl]-3,5-difluoropyridine
CID 170522177
5-[5-fluoro-2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]benzene-1,3-diol
CID 154679884
2-[6-[4-[2-(3,5-dimethylphenyl)phenyl]-3-phenylphenyl]-3-pyridinyl]-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 140838721
5-[2-[3-bromo-5-[2-(4,6-diphenyl-3-pyridinyl)phenyl]phenyl]phenyl]-2,4-diphenylpyridine;methane
CID 158084559
2-[4-[2-[3-[2-[4-(4-tert-butyl-2-pyridinyl)-2-phenylphenyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine
CID 134226053
benzene;5-[2-[3-bromo-5-[2-(4,6-diphenyl-3-pyridinyl)phenyl]phenyl]phenyl]-2-methyl-4-phenylpyridine;ethane
CID 145132481
2-[4-[2-[3-[2-(4,6-diphenyl-3-pyridinyl)phenyl]-5-methoxyphenyl]phenyl]phenyl]-4-methyl-5-phenylpyridine;ethane
CID 142521070

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine?
The IUPAC name of 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine (CID 162085107) is 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine.
What is the SMILES notation for 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine?
The canonical SMILES for 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine is Cc1cc(-c2ccccc2-c2cnc(-c3ccccc3)cc2-c2ccc(-c3ccccc3)cc2)cc(-c2ccccc2-c2cnc(-c3ccc(F)cc3)cc2C(C)C)c1.
What is the InChIKey of 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine?
The InChIKey is AKKOASPQPIYXFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H43FN2/c1-37(2)51-33-55(43-26-28-46(57)29-27-43)58-35-53(51)49-20-12-10-18-47(49)44-30-38(3)31-45(32-44)48-19-11-13-21-50(48)54-36-59-56(42-16-8-5-9-17-42)34-52(54)41-24-22-40(23-25-41)39-14-6-4-7-15-39/h4-37H,1-3H3.
What are the key properties of 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine?
2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine has a molecular weight of 762.97 g/mol, XLogP of 15.38, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-5-[2-[3-methyl-5-[2-[6-phenyl-4-(4-phenylphenyl)-3-pyridinyl]phenyl]phenyl]phenyl]-4-propan-2-ylpyridine is sourced from PubChem (CID 162085107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).