N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline

C100H82N4 — CID 130325250

About N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline

N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline (PubChem CID 130325250) has the molecular formula C100H82N4 and a molecular weight of 1339.78 g/mol. Its IUPAC name is N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline.

Molecular Properties

• Compound Name: N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline
• PubChem CID: 130325250
• Molecular Formula: C100H82N4
• Molecular Weight: 1339.78 g/mol
• Exact Mass: 1338.65
• IUPAC Name: N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline
• SMILES: Cc1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc(Cc6ccc(/C(=C/N(c7ccc(-c8ccc(N(C=C(c9ccccc9)c9ccccc9)c9ccc(C)cc9C)cc8)cc7)c7ccc(C)cc7C)c7ccccc7)cc6)cc5)cc4)cc3)cc2)cc1
• InChI: InChI=1S/C100H82N4/c1-72-31-53-93(54-32-72)103(91-27-17-9-18-28-91)95-61-49-83(50-62-95)79-41-43-80(44-42-79)84-51-63-96(64-52-84)104(92-29-19-10-20-30-92)94-55-37-78(38-56-94)69-77-35-39-88(40-36-77)98(87-25-15-8-16-26-87)71-102(100-66-34-74(3)68-76(100)5)90-59-47-82(48-60-90)81-45-57-89(58-46-81)101(99-65-33-73(2)67-75(99)4)70-97(85-21-11-6-12-22-85)86-23-13-7-14-24-86/h6-68,70-71H,69H2,1-5H3/b98-71+
• InChIKey: UIOQVYGIVDKJBS-GYCHSZIXSA-N
• XLogP: 27.22
• TPSA: 12.96 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 21
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1339.78
LogP ≤ 5	27.22
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hzone_phenone(7)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline?

The IUPAC name of N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline (CID 130325250) is N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline.

What is the SMILES notation for N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline?

The canonical SMILES for N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline is Cc1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc(Cc6ccc(/C(=C/N(c7ccc(-c8ccc(N(C=C(c9ccccc9)c9ccccc9)c9ccc(C)cc9C)cc8)cc7)c7ccc(C)cc7C)c7ccccc7)cc6)cc5)cc4)cc3)cc2)cc1.

What is the InChIKey of N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline?

The InChIKey is UIOQVYGIVDKJBS-GYCHSZIXSA-N. The full InChI is InChI=1S/C100H82N4/c1-72-31-53-93(54-32-72)103(91-27-17-9-18-28-91)95-61-49-83(50-62-95)79-41-43-80(44-42-79)84-51-63-96(64-52-84)104(92-29-19-10-20-30-92)94-55-37-78(38-56-94)69-77-35-39-88(40-36-77)98(87-25-15-8-16-26-87)71-102(100-66-34-74(3)68-76(100)5)90-59-47-82(48-60-90)81-45-57-89(58-46-81)101(99-65-33-73(2)67-75(99)4)70-97(85-21-11-6-12-22-85)86-23-13-7-14-24-86/h6-68,70-71H,69H2,1-5H3/b98-71+.

What are the key properties of N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline?

N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline has a molecular weight of 1339.78 g/mol, XLogP of 27.22, 21 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[4-(2,4-dimethyl-N-[(E)-2-[4-[[4-(N-[4-[4-[4-(N-(4-methylphenyl)anilino)phenyl]phenyl]phenyl]anilino)phenyl]methyl]phenyl]-2-phenylethenyl]anilino)phenyl]phenyl]-N-(2,2-diphenylethenyl)-2,4-dimethylaniline is sourced from PubChem (CID 130325250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).