2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline

C60H43N — CID 174254180

IUPAC2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
SMILESc1ccc(-c2cccc(N(c3ccc(-c4ccccc4-c4ccccc4-c4ccccc4)cc3)c3cc(-c4ccccc4)cc(-c4ccccc4)c3-c3ccccc3)c2)cc1
InChIInChI=1S/C60H43N/c1-6-21-44(22-7-1)50-31-20-32-53(41-50)61(52-39-37-48(38-40-52)55-34-17-19-36-57(55)56-35-18-16-33-54(56)46-25-10-3-11-26-46)59-43-51(45-23-8-2-9-24-45)42-58(47-27-12-4-13-28-47)60(59)49-29-14-5-15-30-49/h1-43H
InChIKeyZWGCBMQZKGDWOP-UHFFFAOYSA-N
MW778.01 g/mol
LogP16.83
Rot. Bonds10

About 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline

2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline (PubChem CID 174254180) has the molecular formula C60H43N and a molecular weight of 778.01 g/mol. Its IUPAC name is 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline.

Molecular Properties

Compound Name2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
PubChem CID174254180
Molecular FormulaC60H43N
Molecular Weight778.01 g/mol
Exact Mass777.34
IUPAC Name2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
SMILESc1ccc(-c2cccc(N(c3ccc(-c4ccccc4-c4ccccc4-c4ccccc4)cc3)c3cc(-c4ccccc4)cc(-c4ccccc4)c3-c3ccccc3)c2)cc1
InChIInChI=1S/C60H43N/c1-6-21-44(22-7-1)50-31-20-32-53(41-50)61(52-39-37-48(38-40-52)55-34-17-19-36-57(55)56-35-18-16-33-54(56)46-25-10-3-11-26-46)59-43-51(45-23-8-2-9-24-45)42-58(47-27-12-4-13-28-47)60(59)49-29-14-5-15-30-49/h1-43H
InChIKeyZWGCBMQZKGDWOP-UHFFFAOYSA-N
XLogP16.83
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500778.01
LogP ≤ 516.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-phenylphenyl)-2-[2-(2-phenylphenyl)phenyl]-N-[4-(2-phenylphenyl)phenyl]aniline
CID 172502893
N,2,3-triphenyl-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
CID 174254069
3-phenyl-N-(4-phenylphenyl)-N-[4-[2-[4-(4-phenyl-N-(3-phenylphenyl)anilino)phenyl]phenyl]phenyl]aniline
CID 121386998
N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-3-(2,4,6-triphenylphenyl)aniline
CID 126492683
2-phenyl-N-(3-phenylphenyl)-N-(4-phenylphenyl)aniline;2-phenyl-N-(3-phenylphenyl)-N-[3-(2-phenylphenyl)phenyl]aniline;2-phenyl-N-(3-phenylphenyl)-N-[3-(3-phenylphenyl)phenyl]aniline;2-phenyl-N-(3-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]aniline
CID 159359391
2-phenyl-N-(3-phenylphenyl)-N-[4-[3-(4-phenyl-N-(3-phenylphenyl)anilino)phenyl]phenyl]aniline
CID 118924577
2,4-diphenyl-N-(4-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline
CID 174254123
3-phenyl-N-[4-(2-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-[2-(3-phenylphenyl)phenyl]phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-[2-(4-phenylphenyl)phenyl]phenyl]aniline
CID 161496261
N-(3-phenylphenyl)-N-(4-phenylphenyl)-2-[2-(4-phenyl-N-(3-phenylphenyl)anilino)phenyl]aniline
CID 139322197
3-(2-phenylphenyl)-N,N-bis[4-[4-(4-phenylphenyl)phenyl]phenyl]aniline
CID 146665629
N-[4-(2,4-diphenylphenyl)phenyl]-3,5-diphenyl-N-(3-phenylphenyl)aniline
CID 146664996
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

Frequently Asked Questions

What is the IUPAC name of 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline?
The IUPAC name of 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline (CID 174254180) is 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline.
What is the SMILES notation for 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline?
The canonical SMILES for 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline is c1ccc(-c2cccc(N(c3ccc(-c4ccccc4-c4ccccc4-c4ccccc4)cc3)c3cc(-c4ccccc4)cc(-c4ccccc4)c3-c3ccccc3)c2)cc1.
What is the InChIKey of 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline?
The InChIKey is ZWGCBMQZKGDWOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H43N/c1-6-21-44(22-7-1)50-31-20-32-53(41-50)61(52-39-37-48(38-40-52)55-34-17-19-36-57(55)56-35-18-16-33-54(56)46-25-10-3-11-26-46)59-43-51(45-23-8-2-9-24-45)42-58(47-27-12-4-13-28-47)60(59)49-29-14-5-15-30-49/h1-43H.
What are the key properties of 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline?
2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline has a molecular weight of 778.01 g/mol, XLogP of 16.83, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-triphenyl-N-(3-phenylphenyl)-N-[4-[2-(2-phenylphenyl)phenyl]phenyl]aniline is sourced from PubChem (CID 174254180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).