benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+)

C122H76BrCl2N9O5Pt2 — CID 158236681

IUPACbenzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+)
SMILESBrc1cccc(-c2cc3c(cn2)oc2ccccc23)c1.Cl[Pt]Cl.N#Cc1ccccc1.Nc1cccc2ccccc12.[Pt+2].[c-]1c(-c2cc3c(cn2)oc2ccccc23)cccc1N(c1[c-]c(-c2cc3c(cn2)oc2ccccc23)ccc1)c1cccc2ccccc12.c1cc(-c2cc3c(cn2)oc2ccccc23)cc(N(c2cccc(-c3cc4c(cn3)oc3ccccc34)c2)c2cccc3ccccc23)c1
InChIInChI=1S/C44H27N3O2.C44H25N3O2.C17H10BrNO.C10H9N.C7H5N.2ClH.2Pt/c2*1-2-16-33-28(10-1)11-9-19-40(33)47(31-14-7-12-29(22-31)38-24-36-34-17-3-5-20-41(34)48-43(36)26-45-38)32-15-8-13-30(23-32)39-25-37-35-18-4-6-21-42(35)49-44(37)27-46-39;18-12-5-3-4-11(8-12)15-9-14-13-6-1-2-7-16(13)20-17(14)10-19-15;11-10-7-3-5-8-4-1-2-6-9(8)10;8-6-7-4-2-1-3-5-7;;;;/h1-27H;1-21,24-27H;1-10H;1-7H,11H2;1-5H;2*1H;;/q;-2;;;;;;2*+2/p-2
InChIKeyCEVJCPOAEDMWDE-UHFFFAOYSA-L
MW2288.97 g/mol
LogP34.83
Rot. Bonds11

About benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+)

benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+) (PubChem CID 158236681) has the molecular formula C122H76BrCl2N9O5Pt2 and a molecular weight of 2288.97 g/mol. Its IUPAC name is benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+).

Molecular Properties

Compound Namebenzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+)
PubChem CID158236681
Molecular FormulaC122H76BrCl2N9O5Pt2
Molecular Weight2288.97 g/mol
Exact Mass2285.38
IUPAC Namebenzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+)
SMILESBrc1cccc(-c2cc3c(cn2)oc2ccccc23)c1.Cl[Pt]Cl.N#Cc1ccccc1.Nc1cccc2ccccc12.[Pt+2].[c-]1c(-c2cc3c(cn2)oc2ccccc23)cccc1N(c1[c-]c(-c2cc3c(cn2)oc2ccccc23)ccc1)c1cccc2ccccc12.c1cc(-c2cc3c(cn2)oc2ccccc23)cc(N(c2cccc(-c3cc4c(cn3)oc3ccccc34)c2)c2cccc3ccccc23)c1
InChIInChI=1S/C44H27N3O2.C44H25N3O2.C17H10BrNO.C10H9N.C7H5N.2ClH.2Pt/c2*1-2-16-33-28(10-1)11-9-19-40(33)47(31-14-7-12-29(22-31)38-24-36-34-17-3-5-20-41(34)48-43(36)26-45-38)32-15-8-13-30(23-32)39-25-37-35-18-4-6-21-42(35)49-44(37)27-46-39;18-12-5-3-4-11(8-12)15-9-14-13-6-1-2-7-16(13)20-17(14)10-19-15;11-10-7-3-5-8-4-1-2-6-9(8)10;8-6-7-4-2-1-3-5-7;;;;/h1-27H;1-21,24-27H;1-10H;1-7H,11H2;1-5H;2*1H;;/q;-2;;;;;;2*+2/p-2
InChIKeyCEVJCPOAEDMWDE-UHFFFAOYSA-L
XLogP34.83
TPSA186.44 Ų
H-Bond Donors1
H-Bond Acceptors14
Rotatable Bonds11
Heavy Atoms141
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002288.97
LogP ≤ 534.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+) with MolForge

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Related Compounds

N-[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]-3-isoquinolin-3-yl-N-phenylbenzene-2-id-1-amine;N-[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]-N-[3-(5-methyl-4-phenyl-2-pyridinyl)benzene-2-id-1-yl]naphthalen-1-amine;3-([1]benzofuro[2,3-c]pyridin-3-yl)-N-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]-N-phenylbenzene-2-id-1-amine;tris(platinum(2+))
CID 160657018
N-[3-[3-(3-bromophenyl)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 121327934
3-([1]benzofuro[2,3-c]pyridin-3-yl)-N-[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]-N-(2-methylpropyl)aniline
CID 140881709
N-phenyl-3-(7-phenyl-[1]benzofuro[2,3-c]pyridin-3-yl)-N-[3-(7-phenyl-[1]benzofuro[2,3-c]pyridin-3-yl)phenyl]aniline
CID 140881800
N-phenyl-N-[3-(8-phenyldibenzofuran-2-yl)phenyl]naphthalen-1-amine
CID 121296588
N-(4-bromophenyl)-N-naphthalen-1-yldibenzofuran-3-amine
CID 131980093
N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]-4-carbazol-9-yl-2,6-dimethylaniline;platinum(2+)
CID 140881771
N-[4-[3-[4-(N-dibenzofuran-2-ylanilino)phenyl]-5-phenylphenyl]phenyl]-N-phenyldibenzofuran-2-amine;N,N-diphenyl-4-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline;N-[4-[4-[N-naphthalen-1-yl-4-[4-(N-naphthalen-1-ylanilino)phenyl]anilino]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 165024004
N-phenyl-N-[3-(3-phenyl-1-benzofuran-2-yl)phenyl]naphthalen-1-amine
CID 170400225
N-[4-[8-[4-(N-naphthalen-1-ylanilino)phenyl]dibenzofuran-2-yl]phenyl]-N-phenylnaphthalen-1-amine
CID 130438409
N-[3-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-3-yl]phenyl]-N-phenylnaphthalen-1-amine
CID 170095768
8-N,22-N-di(dibenzofuran-3-yl)-8-N,22-N-dinaphthalen-1-yl-5,15,25-trioxaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19(24),20,22,26-dodecaene-8,22-diamine
CID 165046375

Frequently Asked Questions

What is the IUPAC name of benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+)?
The IUPAC name of benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+) (CID 158236681) is benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+).
What is the SMILES notation for benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+)?
The canonical SMILES for benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+) is Brc1cccc(-c2cc3c(cn2)oc2ccccc23)c1.Cl[Pt]Cl.N#Cc1ccccc1.Nc1cccc2ccccc12.[Pt+2].[c-]1c(-c2cc3c(cn2)oc2ccccc23)cccc1N(c1[c-]c(-c2cc3c(cn2)oc2ccccc23)ccc1)c1cccc2ccccc12.c1cc(-c2cc3c(cn2)oc2ccccc23)cc(N(c2cccc(-c3cc4c(cn3)oc3ccccc34)c2)c2cccc3ccccc23)c1.
What is the InChIKey of benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+)?
The InChIKey is CEVJCPOAEDMWDE-UHFFFAOYSA-L. The full InChI is InChI=1S/C44H27N3O2.C44H25N3O2.C17H10BrNO.C10H9N.C7H5N.2ClH.2Pt/c2*1-2-16-33-28(10-1)11-9-19-40(33)47(31-14-7-12-29(22-31)38-24-36-34-17-3-5-20-41(34)48-43(36)26-45-38)32-15-8-13-30(23-32)39-25-37-35-18-4-6-21-42(35)49-44(37)27-46-39;18-12-5-3-4-11(8-12)15-9-14-13-6-1-2-7-16(13)20-17(14)10-19-15;11-10-7-3-5-8-4-1-2-6-9(8)10;8-6-7-4-2-1-3-5-7;;;;/h1-27H;1-21,24-27H;1-10H;1-7H,11H2;1-5H;2*1H;;/q;-2;;;;;;2*+2/p-2.
What are the key properties of benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+)?
benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+) has a molecular weight of 2288.97 g/mol, XLogP of 34.83, 11 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for benzonitrile;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)benzene-2-id-1-yl]naphthalen-1-amine;N,N-bis[3-([1]benzofuro[2,3-c]pyridin-3-yl)phenyl]naphthalen-1-amine;3-(3-bromophenyl)-[1]benzofuro[2,3-c]pyridine;dichloroplatinum;naphthalen-1-amine;platinum(2+) is sourced from PubChem (CID 158236681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).