benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+)

C144H90BBr2Cl2F13IN11O2Pt — CID 158883943

About benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+)

benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+) (PubChem CID 158883943) has the molecular formula C144H90BBr2Cl2F13IN11O2Pt and a molecular weight of 2816.86 g/mol. Its IUPAC name is benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+).

Molecular Properties

• Compound Name: benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+)
• PubChem CID: 158883943
• Molecular Formula: C144H90BBr2Cl2F13IN11O2Pt
• Molecular Weight: 2816.86 g/mol
• Exact Mass: 2812.36
• IUPAC Name: benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+)
• SMILES: Fc1cc(-c2cc(-c3ccccc3)c(F)cn2)[c-]c(N(c2[c-]c(-c3cc(-c4ccccc4)c(F)cn3)cc(F)c2)c2cccc3ccccc23)c1.Fc1cc(-c2cc(-c3ccccc3)c(F)cn2)cc(N(c2cc(F)cc(-c3cc(-c4ccccc4)c(F)cn3)c2)c2cccc3ccccc23)c1.Fc1cc(Br)cc(-c2cc(-c3ccccc3)c(F)cn2)c1.Fc1cnc(Cl)cc1-c1ccccc1.Fc1cnc(Cl)cc1I.N#Cc1ccccc1.Nc1cccc2ccccc12.OB(O)c1cc(F)cc(Br)c1.[Pt+2]
• InChI: InChI=1S/C44H27F4N3.C44H25F4N3.C17H10BrF2N.C11H7ClFN.C10H9N.C7H5N.C6H5BBrFO2.C5H2ClFIN.Pt/c2*45-33-18-31(42-24-38(40(47)26-49-42)29-10-3-1-4-11-29)20-35(22-33)51(44-17-9-15-28-14-7-8-16-37(28)44)36-21-32(19-34(46)23-36)43-25-39(41(48)27-50-43)30-12-5-2-6-13-30;18-13-6-12(7-14(19)8-13)17-9-15(16(20)10-21-17)11-4-2-1-3-5-11;12-11-6-9(10(13)7-14-11)8-4-2-1-3-5-8;11-10-7-3-5-8-4-1-2-6-9(8)10;8-6-7-4-2-1-3-5-7;8-5-1-4(7(10)11)2-6(9)3-5;6-5-1-4(8)3(7)2-9-5;/h1-27H;1-19,22-27H;1-10H;1-7H;1-7H,11H2;1-5H;1-3,10-11H;1-2H;/q;-2;;;;;;;+2
• InChIKey: OPAQQXCTRNUYGA-UHFFFAOYSA-N
• XLogP: 39.97
• TPSA: 186.98 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 13
• Rotatable Bonds: 18
• Heavy Atoms: 177
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2816.86
LogP ≤ 5	39.97
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	13

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'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+)?

The IUPAC name of benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+) (CID 158883943) is benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+).

What is the SMILES notation for benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+)?

The canonical SMILES for benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+) is Fc1cc(-c2cc(-c3ccccc3)c(F)cn2)[c-]c(N(c2[c-]c(-c3cc(-c4ccccc4)c(F)cn3)cc(F)c2)c2cccc3ccccc23)c1.Fc1cc(-c2cc(-c3ccccc3)c(F)cn2)cc(N(c2cc(F)cc(-c3cc(-c4ccccc4)c(F)cn3)c2)c2cccc3ccccc23)c1.Fc1cc(Br)cc(-c2cc(-c3ccccc3)c(F)cn2)c1.Fc1cnc(Cl)cc1-c1ccccc1.Fc1cnc(Cl)cc1I.N#Cc1ccccc1.Nc1cccc2ccccc12.OB(O)c1cc(F)cc(Br)c1.[Pt+2].

What is the InChIKey of benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+)?

The InChIKey is OPAQQXCTRNUYGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H27F4N3.C44H25F4N3.C17H10BrF2N.C11H7ClFN.C10H9N.C7H5N.C6H5BBrFO2.C5H2ClFIN.Pt/c2*45-33-18-31(42-24-38(40(47)26-49-42)29-10-3-1-4-11-29)20-35(22-33)51(44-17-9-15-28-14-7-8-16-37(28)44)36-21-32(19-34(46)23-36)43-25-39(41(48)27-50-43)30-12-5-2-6-13-30;18-13-6-12(7-14(19)8-13)17-9-15(16(20)10-21-17)11-4-2-1-3-5-11;12-11-6-9(10(13)7-14-11)8-4-2-1-3-5-8;11-10-7-3-5-8-4-1-2-6-9(8)10;8-6-7-4-2-1-3-5-7;8-5-1-4(7(10)11)2-6(9)3-5;6-5-1-4(8)3(7)2-9-5;/h1-27H;1-19,22-27H;1-10H;1-7H;1-7H,11H2;1-5H;1-3,10-11H;1-2H;/q;-2;;;;;;;+2.

What are the key properties of benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+)?

benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+) has a molecular weight of 2816.86 g/mol, XLogP of 39.97, 18 rotatable bonds, 3 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for benzonitrile;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)benzene-6-id-1-yl]naphthalen-1-amine;N,N-bis[3-fluoro-5-(5-fluoro-4-phenyl-2-pyridinyl)phenyl]naphthalen-1-amine;(3-bromo-5-fluorophenyl)boronic acid;2-(3-bromo-5-fluorophenyl)-5-fluoro-4-phenylpyridine;2-chloro-5-fluoro-4-iodopyridine;2-chloro-5-fluoro-4-phenylpyridine;naphthalen-1-amine;platinum(2+) is sourced from PubChem (CID 158883943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).