N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene

C108H78N2 — CID 162190398

About N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene

N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene (PubChem CID 162190398) has the molecular formula C108H78N2 and a molecular weight of 1403.83 g/mol. Its IUPAC name is N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene.

Molecular Properties

• Compound Name: N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene
• PubChem CID: 162190398
• Molecular Formula: C108H78N2
• Molecular Weight: 1403.83 g/mol
• Exact Mass: 1402.62
• IUPAC Name: N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene
• SMILES: C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2c3ccccc3c(-c3ccc(CC(c4ccccc4)c4ccccc4)cc3)c3ccccc23)cc1.C(=C/c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1)\c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1
• InChI: InChI=1S/C54H38N2.C54H40/c1-5-13-45-35-51(31-23-41(45)9-1)55(52-32-24-42-10-2-6-14-46(42)36-52)49-27-19-39(20-28-49)17-18-40-21-29-50(30-22-40)56(53-33-25-43-11-3-7-15-47(43)37-53)54-34-26-44-12-4-8-16-48(44)38-54;1-5-17-41(18-6-1)51(42-19-7-2-8-20-42)37-39-29-33-45(34-30-39)53-47-25-13-15-27-49(47)54(50-28-16-14-26-48(50)53)46-35-31-40(32-36-46)38-52(43-21-9-3-10-22-43)44-23-11-4-12-24-44/h1-38H;1-37,52H,38H2/b18-17+
• InChIKey: ZQFLSDAFLRYHME-ZAGWXBKKSA-N
• XLogP: 29.70
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 17
• Heavy Atoms: 110
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1403.83
LogP ≤ 5	29.70
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene?

The IUPAC name of N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene (CID 162190398) is N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene.

What is the SMILES notation for N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene?

The canonical SMILES for N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene is C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2c3ccccc3c(-c3ccc(CC(c4ccccc4)c4ccccc4)cc3)c3ccccc23)cc1.C(=C/c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1)\c1ccc(N(c2ccc3ccccc3c2)c2ccc3ccccc3c2)cc1.

What is the InChIKey of N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene?

The InChIKey is ZQFLSDAFLRYHME-ZAGWXBKKSA-N. The full InChI is InChI=1S/C54H38N2.C54H40/c1-5-13-45-35-51(31-23-41(45)9-1)55(52-32-24-42-10-2-6-14-46(42)36-52)49-27-19-39(20-28-49)17-18-40-21-29-50(30-22-40)56(53-33-25-43-11-3-7-15-47(43)37-53)54-34-26-44-12-4-8-16-48(44)38-54;1-5-17-41(18-6-1)51(42-19-7-2-8-20-42)37-39-29-33-45(34-30-39)53-47-25-13-15-27-49(47)54(50-28-16-14-26-48(50)53)46-35-31-40(32-36-46)38-52(43-21-9-3-10-22-43)44-23-11-4-12-24-44/h1-38H;1-37,52H,38H2/b18-17+;.

What are the key properties of N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene?

N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene has a molecular weight of 1403.83 g/mol, XLogP of 29.70, 17 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[(E)-2-[4-(dinaphthalen-2-ylamino)phenyl]ethenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;9-[4-(2,2-diphenylethenyl)phenyl]-10-[4-(2,2-diphenylethyl)phenyl]anthracene is sourced from PubChem (CID 162190398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).