N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+))

C119H81N11Pt2 — CID 158092226

About N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+))

N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+)) (PubChem CID 158092226) has the molecular formula C119H81N11Pt2 and a molecular weight of 2055.19 g/mol. Its IUPAC name is N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+)).

Molecular Properties

• Compound Name: N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+))
• PubChem CID: 158092226
• Molecular Formula: C119H81N11Pt2
• Molecular Weight: 2055.19 g/mol
• Exact Mass: 2053.60
• IUPAC Name: N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+))
• SMILES: CC1(C)c2ccccc2-c2cc3c4cc(-c5cccc(N(c6[c-]c(-c7ccccn7)ccc6)c6[c-]c(-c7ccccn7)ccc6)c5)ccc4n(-c4ccccc4)c3cc21.CC1(C)c2ccccc2-c2cc3c4cc(-c5cccc(N(c6[c-]c(-c7ccccn7)ccc6)c6[c-]c(-c7ccccn7)ccc6)c5)ccc4n(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3cc21.[Pt+2].[Pt+2]
• InChI: InChI=1S/C64H43N7.C55H38N4.2Pt/c1-64(2)55-29-10-9-28-51(55)52-40-54-53-39-45(32-33-59(53)71(60(54)41-56(52)64)63-68-61(42-18-5-3-6-19-42)67-62(69-63)43-20-7-4-8-21-43)44-22-15-25-48(36-44)70(49-26-16-23-46(37-49)57-30-11-13-34-65-57)50-27-17-24-47(38-50)58-31-12-14-35-66-58;1-55(2)49-24-7-6-23-45(49)46-35-48-47-34-38(27-28-53(47)59(54(48)36-50(46)55)41-18-4-3-5-19-41)37-15-12-20-42(31-37)58(43-21-13-16-39(32-43)51-25-8-10-29-56-51)44-22-14-17-40(33-44)52-26-9-11-30-57-52;;/h3-36,39-41H,1-2H3;3-31,34-36H,1-2H3;;/q2*-2;2*+2
• InChIKey: RJOUHYILUHEKTC-UHFFFAOYSA-N
• XLogP: 29.42
• TPSA: 106.57 Ų
• H-Bond Acceptors: 11
• Rotatable Bonds: 16
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2055.19
LogP ≤ 5	29.42
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+))?

The IUPAC name of N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+)) (CID 158092226) is N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+)).

What is the SMILES notation for N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+))?

The canonical SMILES for N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+)) is CC1(C)c2ccccc2-c2cc3c4cc(-c5cccc(N(c6[c-]c(-c7ccccn7)ccc6)c6[c-]c(-c7ccccn7)ccc6)c5)ccc4n(-c4ccccc4)c3cc21.CC1(C)c2ccccc2-c2cc3c4cc(-c5cccc(N(c6[c-]c(-c7ccccn7)ccc6)c6[c-]c(-c7ccccn7)ccc6)c5)ccc4n(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3cc21.[Pt+2].[Pt+2].

What is the InChIKey of N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+))?

The InChIKey is RJOUHYILUHEKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H43N7.C55H38N4.2Pt/c1-64(2)55-29-10-9-28-51(55)52-40-54-53-39-45(32-33-59(53)71(60(54)41-56(52)64)63-68-61(42-18-5-3-6-19-42)67-62(69-63)43-20-7-4-8-21-43)44-22-15-25-48(36-44)70(49-26-16-23-46(37-49)57-30-11-13-34-65-57)50-27-17-24-47(38-50)58-31-12-14-35-66-58;1-55(2)49-24-7-6-23-45(49)46-35-48-47-34-38(27-28-53(47)59(54(48)36-50(46)55)41-18-4-3-5-19-41)37-15-12-20-42(31-37)58(43-21-13-16-39(32-43)51-25-8-10-29-56-51)44-22-14-17-40(33-44)52-26-9-11-30-57-52;;/h3-36,39-41H,1-2H3;3-31,34-36H,1-2H3;;/q2*-2;2*+2.

What are the key properties of N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+))?

N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+)) has a molecular weight of 2055.19 g/mol, XLogP of 29.42, 16 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-(7,7-dimethyl-5-phenylindeno[2,1-b]carbazol-2-yl)phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;N-[3-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)-7,7-dimethylindeno[2,1-b]carbazol-2-yl]phenyl]-3-pyridin-2-yl-N-(3-pyridin-2-ylbenzene-2-id-1-yl)benzene-2-id-1-amine;bis(platinum(2+)) is sourced from PubChem (CID 158092226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).