benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+)

C151H112BBr3F6N10O2Pt — CID 158234505

About benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+)

benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+) (PubChem CID 158234505) has the molecular formula C151H112BBr3F6N10O2Pt and a molecular weight of 2658.21 g/mol. Its IUPAC name is benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+).

Molecular Properties

• Compound Name: benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+)
• PubChem CID: 158234505
• Molecular Formula: C151H112BBr3F6N10O2Pt
• Molecular Weight: 2658.21 g/mol
• Exact Mass: 2653.62
• IUPAC Name: benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+)
• SMILES: Cc1cnc(-c2[c-]c(N(c3[c-]c(-c4cc(-c5ccccc5)c(C)cn4)cc(F)c3)c3ccccc3-c3ccccc3)cc(F)c2)cc1-c1ccccc1.Cc1cnc(-c2cc(F)cc(Br)c2)cc1-c1ccccc1.Cc1cnc(-c2cc(F)cc(N(c3cc(F)cc(-c4cc(-c5ccccc5)c(C)cn4)c3)c3ccccc3-c3ccccc3)c2)cc1-c1ccccc1.Cc1cnc(Br)cc1-c1ccccc1.N#Cc1ccccc1.Nc1ccccc1-c1ccccc1.OB(O)c1cc(F)cc(Br)c1.[Pt+2]
• InChI: InChI=1S/C48H35F2N3.C48H33F2N3.C18H13BrFN.C12H10BrN.C12H11N.C7H5N.C6H5BBrFO2.Pt/c2*1-32-30-51-46(28-44(32)35-16-8-4-9-17-35)37-22-39(49)26-41(24-37)53(48-21-13-12-20-43(48)34-14-6-3-7-15-34)42-25-38(23-40(50)27-42)47-29-45(33(2)31-52-47)36-18-10-5-11-19-36;1-12-11-21-18(14-7-15(19)9-16(20)8-14)10-17(12)13-5-3-2-4-6-13;1-9-8-14-12(13)7-11(9)10-5-3-2-4-6-10;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;8-6-7-4-2-1-3-5-7;8-5-1-4(7(10)11)2-6(9)3-5;/h3-31H,1-2H3;3-23,26-31H,1-2H3;2-11H,1H3;2-8H,1H3;1-9H,13H2;1-5H;1-3,10-11H;/q;-2;;;;;;+2
• InChIKey: FJCIWDKRSFBLDC-UHFFFAOYSA-N
• XLogP: 40.16
• TPSA: 174.09 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 12
• Rotatable Bonds: 21
• Heavy Atoms: 174
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2658.21
LogP ≤ 5	40.16
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	12

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+)?

The IUPAC name of benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+) (CID 158234505) is benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+).

What is the SMILES notation for benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+)?

The canonical SMILES for benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+) is Cc1cnc(-c2[c-]c(N(c3[c-]c(-c4cc(-c5ccccc5)c(C)cn4)cc(F)c3)c3ccccc3-c3ccccc3)cc(F)c2)cc1-c1ccccc1.Cc1cnc(-c2cc(F)cc(Br)c2)cc1-c1ccccc1.Cc1cnc(-c2cc(F)cc(N(c3cc(F)cc(-c4cc(-c5ccccc5)c(C)cn4)c3)c3ccccc3-c3ccccc3)c2)cc1-c1ccccc1.Cc1cnc(Br)cc1-c1ccccc1.N#Cc1ccccc1.Nc1ccccc1-c1ccccc1.OB(O)c1cc(F)cc(Br)c1.[Pt+2].

What is the InChIKey of benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+)?

The InChIKey is FJCIWDKRSFBLDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H35F2N3.C48H33F2N3.C18H13BrFN.C12H10BrN.C12H11N.C7H5N.C6H5BBrFO2.Pt/c2*1-32-30-51-46(28-44(32)35-16-8-4-9-17-35)37-22-39(49)26-41(24-37)53(48-21-13-12-20-43(48)34-14-6-3-7-15-34)42-25-38(23-40(50)27-42)47-29-45(33(2)31-52-47)36-18-10-5-11-19-36;1-12-11-21-18(14-7-15(19)9-16(20)8-14)10-17(12)13-5-3-2-4-6-13;1-9-8-14-12(13)7-11(9)10-5-3-2-4-6-10;13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;8-6-7-4-2-1-3-5-7;8-5-1-4(7(10)11)2-6(9)3-5;/h3-31H,1-2H3;3-23,26-31H,1-2H3;2-11H,1H3;2-8H,1H3;1-9H,13H2;1-5H;1-3,10-11H;/q;-2;;;;;;+2.

What are the key properties of benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+)?

benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+) has a molecular weight of 2658.21 g/mol, XLogP of 40.16, 21 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for benzonitrile;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-methyl-4-phenylpyridine;2-bromo-5-methyl-4-phenylpyridine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)benzene-6-id-1-amine;3-fluoro-N-[3-fluoro-5-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-5-(5-methyl-4-phenyl-2-pyridinyl)-N-(2-phenylphenyl)aniline;2-phenylaniline;platinum(2+) is sourced from PubChem (CID 158234505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).