N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline

C144H116N4 — CID 160901094

About N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline

N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline (PubChem CID 160901094) has the molecular formula C144H116N4 and a molecular weight of 1902.54 g/mol. Its IUPAC name is N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline.

Molecular Properties

• Compound Name: N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline
• PubChem CID: 160901094
• Molecular Formula: C144H116N4
• Molecular Weight: 1902.54 g/mol
• Exact Mass: 1900.92
• IUPAC Name: N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline
• SMILES: Cc1ccc(N(c2ccc(-c3ccc(-c4ccc5cc6cc(-c7ccc(-c8ccc(N(c9ccc(C)c(C)c9)c9cccc%10ccccc9%10)cc8)cc7)ccc6cc5c4)cc3)cc2)c2cccc3ccccc23)c(C)c1.Cc1ccc(N(c2ccc(-c3ccc(-c4ccc5cc6cc(-c7ccc(-c8ccc(N(c9ccc(C)cc9C)c9ccc(C)cc9C)cc8)cc7)ccc6cc5c4)cc3)cc2)c2ccc(C)cc2C)c(C)c1
• InChI: InChI=1S/C74H56N2.C70H60N2/c1-49-19-42-72(52(4)43-49)76(74-18-10-14-60-12-6-8-16-71(60)74)68-40-35-56(36-41-68)54-23-27-58(28-24-54)62-30-32-64-47-65-45-61(29-31-63(65)48-66(64)46-62)57-25-21-53(22-26-57)55-33-38-67(39-34-55)75(69-37-20-50(2)51(3)44-69)73-17-9-13-59-11-5-7-15-70(59)73;1-45-9-33-67(49(5)37-45)71(68-34-10-46(2)38-50(68)6)65-29-25-55(26-30-65)53-13-17-57(18-14-53)59-21-23-61-44-64-42-60(22-24-62(64)43-63(61)41-59)58-19-15-54(16-20-58)56-27-31-66(32-28-56)72(69-35-11-47(3)39-51(69)7)70-36-12-48(4)40-52(70)8/h5-48H,1-4H3;9-44H,1-8H3
• InChIKey: SPNASMJNOGCMTK-UHFFFAOYSA-N
• XLogP: 41.21
• TPSA: 12.96 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 20
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1902.54
LogP ≤ 5	41.21
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline?

The IUPAC name of N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline (CID 160901094) is N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline.

What is the SMILES notation for N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline?

The canonical SMILES for N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline is Cc1ccc(N(c2ccc(-c3ccc(-c4ccc5cc6cc(-c7ccc(-c8ccc(N(c9ccc(C)c(C)c9)c9cccc%10ccccc9%10)cc8)cc7)ccc6cc5c4)cc3)cc2)c2cccc3ccccc23)c(C)c1.Cc1ccc(N(c2ccc(-c3ccc(-c4ccc5cc6cc(-c7ccc(-c8ccc(N(c9ccc(C)cc9C)c9ccc(C)cc9C)cc8)cc7)ccc6cc5c4)cc3)cc2)c2ccc(C)cc2C)c(C)c1.

What is the InChIKey of N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline?

The InChIKey is SPNASMJNOGCMTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H56N2.C70H60N2/c1-49-19-42-72(52(4)43-49)76(74-18-10-14-60-12-6-8-16-71(60)74)68-40-35-56(36-41-68)54-23-27-58(28-24-54)62-30-32-64-47-65-45-61(29-31-63(65)48-66(64)46-62)57-25-21-53(22-26-57)55-33-38-67(39-34-55)75(69-37-20-50(2)51(3)44-69)73-17-9-13-59-11-5-7-15-70(59)73;1-45-9-33-67(49(5)37-45)71(68-34-10-46(2)38-50(68)6)65-29-25-55(26-30-65)53-13-17-57(18-14-53)59-21-23-61-44-64-42-60(22-24-62(64)43-63(61)41-59)58-19-15-54(16-20-58)56-27-31-66(32-28-56)72(69-35-11-47(3)39-51(69)7)70-36-12-48(4)40-52(70)8/h5-48H,1-4H3;9-44H,1-8H3.

What are the key properties of N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline?

N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline has a molecular weight of 1902.54 g/mol, XLogP of 41.21, 20 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[4-[6-[4-[4-(2,4-dimethyl-N-naphthalen-1-ylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-N-(3,4-dimethylphenyl)naphthalen-1-amine;N-(2,4-dimethylphenyl)-N-[4-[4-[6-[4-[4-(N-(2,4-dimethylphenyl)-2,4-dimethylanilino)phenyl]phenyl]anthracen-2-yl]phenyl]phenyl]-2,4-dimethylaniline is sourced from PubChem (CID 160901094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).