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

C144H105N3 — CID 161496261

About 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

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 (PubChem CID 161496261) has the molecular formula C144H105N3 and a molecular weight of 1877.45 g/mol. Its IUPAC name is 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.

Molecular Properties

• Compound Name: 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
• PubChem CID: 161496261
• Molecular Formula: C144H105N3
• Molecular Weight: 1877.45 g/mol
• Exact Mass: 1875.83
• IUPAC Name: 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
• SMILES: c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5-c5ccccc5)cc4)c4cccc(-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc(-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4-c4cccc(-c5ccccc5)c4)cc3)c3cccc(-c4ccccc4)c3)cc2)cc1
• InChI: InChI=1S/3C48H35N/c1-4-14-36(15-5-1)39-26-30-44(31-27-39)49(46-23-13-21-42(35-46)38-18-8-3-9-19-38)45-32-28-40(29-33-45)47-24-10-11-25-48(47)43-22-12-20-41(34-43)37-16-6-2-7-17-37;1-4-13-36(14-5-1)38-23-25-39(26-24-38)40-27-31-44(32-28-40)49(46-20-12-19-43(35-46)37-15-6-2-7-16-37)45-33-29-42(30-34-45)48-22-11-10-21-47(48)41-17-8-3-9-18-41;1-4-13-36(14-5-1)39-23-25-41(26-24-39)47-21-10-11-22-48(47)42-29-33-45(34-30-42)49(44-31-27-40(28-32-44)37-15-6-2-7-16-37)46-20-12-19-43(35-46)38-17-8-3-9-18-38/h3*1-35H
• InChIKey: WGGBHXLIDOWVQK-UHFFFAOYSA-N
• XLogP: 40.47
• TPSA: 9.72 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 24
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1877.45
LogP ≤ 5	40.47
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 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?

The IUPAC name of 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) is 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.

What is the SMILES notation for 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?

The canonical SMILES for 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 is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5-c5ccccc5)cc4)c4cccc(-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4cccc(-c5ccccc5)c4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4-c4cccc(-c5ccccc5)c4)cc3)c3cccc(-c4ccccc4)c3)cc2)cc1.

What is the InChIKey of 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?

The InChIKey is WGGBHXLIDOWVQK-UHFFFAOYSA-N. The full InChI is InChI=1S/3C48H35N/c1-4-14-36(15-5-1)39-26-30-44(31-27-39)49(46-23-13-21-42(35-46)38-18-8-3-9-19-38)45-32-28-40(29-33-45)47-24-10-11-25-48(47)43-22-12-20-41(34-43)37-16-6-2-7-17-37;1-4-13-36(14-5-1)38-23-25-39(26-24-38)40-27-31-44(32-28-40)49(46-20-12-19-43(35-46)37-15-6-2-7-16-37)45-33-29-42(30-34-45)48-22-11-10-21-47(48)41-17-8-3-9-18-41;1-4-13-36(14-5-1)39-23-25-41(26-24-39)47-21-10-11-22-48(47)42-29-33-45(34-30-42)49(44-31-27-40(28-32-44)37-15-6-2-7-16-37)46-20-12-19-43(35-46)38-17-8-3-9-18-38/h3*1-35H.

What are the key properties of 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?

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 has a molecular weight of 1877.45 g/mol, XLogP of 40.47, 24 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 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 is sourced from PubChem (CID 161496261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).