2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline

C120H90N2Si2 — CID 158589240

IUPAC2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline
SMILESc1ccc(-c2ccc(-c3ccccc3)c(N(c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3ccccc3-c3ccccc3)c2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3cc(-c4ccccc4)ccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/2C60H45NSi/c1-7-21-46(22-8-1)51-39-44-58(50-25-11-3-12-26-50)60(45-51)61(59-34-20-19-33-57(59)49-23-9-2-10-24-49)52-40-35-47(36-41-52)48-37-42-56(43-38-48)62(53-27-13-4-14-28-53,54-29-15-5-16-30-54)55-31-17-6-18-32-55;1-7-19-46(20-8-1)48-31-38-53(39-32-48)61(60-45-52(47-21-9-2-10-22-47)37-44-59(60)51-23-11-3-12-24-51)54-40-33-49(34-41-54)50-35-42-58(43-36-50)62(55-25-13-4-14-26-55,56-27-15-5-16-28-56)57-29-17-6-18-30-57/h2*1-45H
InChIKeyHUFVASHLOFFYEV-UHFFFAOYSA-N
MW1616.23 g/mol
LogP26.40
Rot. Bonds22

About 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline

2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline (PubChem CID 158589240) has the molecular formula C120H90N2Si2 and a molecular weight of 1616.23 g/mol. Its IUPAC name is 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline.

Molecular Properties

Compound Name2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline
PubChem CID158589240
Molecular FormulaC120H90N2Si2
Molecular Weight1616.23 g/mol
Exact Mass1614.66
IUPAC Name2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline
SMILESc1ccc(-c2ccc(-c3ccccc3)c(N(c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3ccccc3-c3ccccc3)c2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3cc(-c4ccccc4)ccc3-c3ccccc3)cc2)cc1
InChIInChI=1S/2C60H45NSi/c1-7-21-46(22-8-1)51-39-44-58(50-25-11-3-12-26-50)60(45-51)61(59-34-20-19-33-57(59)49-23-9-2-10-24-49)52-40-35-47(36-41-52)48-37-42-56(43-38-48)62(53-27-13-4-14-28-53,54-29-15-5-16-30-54)55-31-17-6-18-32-55;1-7-19-46(20-8-1)48-31-38-53(39-32-48)61(60-45-52(47-21-9-2-10-22-47)37-44-59(60)51-23-11-3-12-24-51)54-40-33-49(34-41-54)50-35-42-58(43-36-50)62(55-25-13-4-14-26-55,56-27-15-5-16-28-56)57-29-17-6-18-30-57/h2*1-45H
InChIKeyHUFVASHLOFFYEV-UHFFFAOYSA-N
XLogP26.40
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds22
Heavy Atoms124
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001616.23
LogP ≤ 526.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline with MolForge

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Related Compounds

N-[4-(3,4-diphenylphenyl)phenyl]-N,2-bis(4-phenylphenyl)aniline
CID 164831679
4-phenyl-N-[4-(4-phenylphenyl)phenyl]-N-(4-triphenylsilylphenyl)naphthalen-1-amine
CID 123242691
N-[4-[3,5-bis[4-(2-phenyl-N-(2-phenylphenyl)anilino)phenyl]phenyl]phenyl]-2-phenyl-N-(2-phenylphenyl)aniline
CID 87182000
2-phenyl-N-(4-phenylphenyl)-N-[4-[2-[4-(4-phenyl-N-(2-phenylphenyl)anilino)phenyl]phenyl]phenyl]aniline
CID 121387002
2-phenyl-N,N-bis(3-phenylphenyl)aniline;4-(4-phenylphenyl)-N,N-bis[4-(4-phenylphenyl)phenyl]aniline;2-phenyl-N-(2-phenylphenyl)-N-(3-phenylphenyl)aniline
CID 157451830
N-[4-(3,5-diphenylphenyl)phenyl]-5-naphthalen-2-yl-2-phenyl-N-(2-phenylphenyl)aniline
CID 167233900
2,5-dinaphthalen-2-yl-N-[4-(3-naphthalen-2-ylphenyl)phenyl]-N-(2-phenylphenyl)aniline
CID 167235748
N-[4-(3,5-diphenylphenyl)phenyl]-2,5-dinaphthalen-2-yl-N-(2-phenylphenyl)aniline
CID 167235492
2-phenyl-N-(3-phenylphenyl)-N-[4-[3-(4-phenyl-N-(3-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 118924577
2,4-diphenyl-N-(2-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
CID 174254200
ethane;N,N,2,4,5-pentakis-phenylaniline;N,N,2,4-tetraphenylaniline;N,N,2,5-tetraphenylaniline;N,N,2-triphenylaniline
CID 160837320
5-naphthalen-2-yl-N,N-bis(4-naphthalen-2-ylphenyl)-2-phenylaniline
CID 167235732

Frequently Asked Questions

What is the IUPAC name of 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline?
The IUPAC name of 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline (CID 158589240) is 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline.
What is the SMILES notation for 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline?
The canonical SMILES for 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline is c1ccc(-c2ccc(-c3ccccc3)c(N(c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3ccccc3-c3ccccc3)c2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)c3cc(-c4ccccc4)ccc3-c3ccccc3)cc2)cc1.
What is the InChIKey of 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline?
The InChIKey is HUFVASHLOFFYEV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C60H45NSi/c1-7-21-46(22-8-1)51-39-44-58(50-25-11-3-12-26-50)60(45-51)61(59-34-20-19-33-57(59)49-23-9-2-10-24-49)52-40-35-47(36-41-52)48-37-42-56(43-38-48)62(53-27-13-4-14-28-53,54-29-15-5-16-30-54)55-31-17-6-18-32-55;1-7-19-46(20-8-1)48-31-38-53(39-32-48)61(60-45-52(47-21-9-2-10-22-47)37-44-59(60)51-23-11-3-12-24-51)54-40-33-49(34-41-54)50-35-42-58(43-36-50)62(55-25-13-4-14-26-55,56-27-15-5-16-28-56)57-29-17-6-18-30-57/h2*1-45H.
What are the key properties of 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline?
2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline has a molecular weight of 1616.23 g/mol, XLogP of 26.40, 22 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diphenyl-N-(2-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline;2,5-diphenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline is sourced from PubChem (CID 158589240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).