N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+)

C40H27N3Pt — CID 58871024

IUPACN,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+)
SMILES[Pt+2].[c-]1c(-c2ccccn2)cc(-c2ccccc2)cc1N(c1[c-]c(-c2ccccn2)cc(-c2ccccc2)c1)c1ccccc1
InChIInChI=1S/C40H27N3.Pt/c1-4-14-30(15-5-1)32-24-34(39-20-10-12-22-41-39)28-37(26-32)43(36-18-8-3-9-19-36)38-27-33(31-16-6-2-7-17-31)25-35(29-38)40-21-11-13-23-42-40;/h1-27H;/q-2;+2
InChIKeyGBEUHDFWGOAUFS-UHFFFAOYSA-N
MW744.76 g/mol
LogP10.21
Rot. Bonds7

About N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+)

N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+) (PubChem CID 58871024) has the molecular formula C40H27N3Pt and a molecular weight of 744.76 g/mol. Its IUPAC name is N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+).

Molecular Properties

Compound NameN,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+)
PubChem CID58871024
Molecular FormulaC40H27N3Pt
Molecular Weight744.76 g/mol
Exact Mass744.19
IUPAC NameN,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+)
SMILES[Pt+2].[c-]1c(-c2ccccn2)cc(-c2ccccc2)cc1N(c1[c-]c(-c2ccccn2)cc(-c2ccccc2)c1)c1ccccc1
InChIInChI=1S/C40H27N3.Pt/c1-4-14-30(15-5-1)32-24-34(39-20-10-12-22-41-39)28-37(26-32)43(36-18-8-3-9-19-36)38-27-33(31-16-6-2-7-17-31)25-35(29-38)40-21-11-13-23-42-40;/h1-27H;/q-2;+2
InChIKeyGBEUHDFWGOAUFS-UHFFFAOYSA-N
XLogP10.21
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500744.76
LogP ≤ 510.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-N,4-N-bis[3-(5-methyl-4-naphthalen-2-yl-2-pyridinyl)benzene-2-id-1-yl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N,4-N-bis[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]benzene-2-id-1-yl]-1-N,1-N-diphenylbenzene-1,4-diamine;4-N-[3-[5-methyl-4-(4-phenylphenyl)-2-pyridinyl]-5-phenylbenzene-2-id-1-yl]-1-N,1-N-diphenyl-4-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-1,4-diamine;tris(platinum(2+))
CID 161312418
N,3,5-triphenyl-N-[3-(3-pyridin-2-ylphenyl)phenyl]aniline
CID 140587043
2-[3-[3-[3-(3,5-diphenylphenyl)-5-phenylphenyl]phenyl]benzene-6-id-1-yl]pyridine;iridium
CID 140587213
methane;N-(2-phenylphenyl)-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;platinum(2+)
CID 158290234
bis(2-(4-phenylbenzene-6-id-1-yl)pyridine);platinum(2+)
CID 58939535
iridium;2-[3-[3-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]benzene-6-id-1-yl]pyridine
CID 171461304
N-(2,6-dipyridin-2-yl-4-pyridinyl)-N-phenyl-2,6-dipyridin-2-ylpyridin-4-amine
CID 102395137
[4-[bis(3-pyridin-2-ylbenzene-2-id-1-yl)amino]phenyl]-triphenylazanium;N-(4-carbazol-9-ylphenyl)-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;3,5-ditert-butyl-N,N-bis(3-pyridin-2-ylbenzene-2-id-1-yl)aniline;N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;hexakis(platinum(2+));2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)benzene-2-id-1-yl]oxypyridine;2,4,6-trimethyl-N,N-bis(3-pyridin-2-ylbenzene-2-id-1-yl)aniline
CID 158436843
2,4,6-trimethyl-N-(3-phenyl-5-pyridin-2-ylphenyl)-N-(3-pyridin-2-ylphenyl)aniline
CID 140758620
CID 161022211
CID 161022211
4-ethynyl-N,N-diphenylaniline;gold;2-(3-pyridin-2-ylbenzene-2-id-1-yl)pyridine
CID 140592761
4-phenyl-2-[6-[6-(4-phenyl-6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]-6-pyridin-2-ylpyridine
CID 15788654

Frequently Asked Questions

What is the IUPAC name of N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+)?
The IUPAC name of N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+) (CID 58871024) is N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+).
What is the SMILES notation for N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+)?
The canonical SMILES for N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+) is [Pt+2].[c-]1c(-c2ccccn2)cc(-c2ccccc2)cc1N(c1[c-]c(-c2ccccn2)cc(-c2ccccc2)c1)c1ccccc1.
What is the InChIKey of N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+)?
The InChIKey is GBEUHDFWGOAUFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H27N3.Pt/c1-4-14-30(15-5-1)32-24-34(39-20-10-12-22-41-39)28-37(26-32)43(36-18-8-3-9-19-36)38-27-33(31-16-6-2-7-17-31)25-35(29-38)40-21-11-13-23-42-40;/h1-27H;/q-2;+2.
What are the key properties of N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+)?
N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+) has a molecular weight of 744.76 g/mol, XLogP of 10.21, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-diphenyl-N-(3-phenyl-5-pyridin-2-ylbenzene-6-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-amine;platinum(2+) is sourced from PubChem (CID 58871024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).