9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine

C102H82N2O2 — CID 139365391

About 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine

9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine (PubChem CID 139365391) has the molecular formula C102H82N2O2 and a molecular weight of 1367.79 g/mol. Its IUPAC name is 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine.

Molecular Properties

• Compound Name: 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
• PubChem CID: 139365391
• Molecular Formula: C102H82N2O2
• Molecular Weight: 1367.79 g/mol
• Exact Mass: 1366.64
• IUPAC Name: 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
• SMILES: C=Cc1ccc(OCCCCC2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc7c(c6)C(CCCCOc6ccc(C=C)cc6)(c6ccccc6)c6ccccc6-7)c6ccccc56)cc4)cc32)cc1
• InChI: InChI=1S/C102H82N2O2/c1-3-73-41-59-87(60-42-73)105-69-25-23-67-101(80-31-13-7-14-32-80)96-39-21-19-36-91(96)93-63-57-85(71-98(93)101)103(82-51-45-77(46-52-82)75-27-9-5-10-28-75)83-55-49-79(50-56-83)89-65-66-100(95-38-18-17-35-90(89)95)104(84-53-47-78(48-54-84)76-29-11-6-12-30-76)86-58-64-94-92-37-20-22-40-97(92)102(99(94)72-86,81-33-15-8-16-34-81)68-24-26-70-106-88-61-43-74(4-2)44-62-88/h3-22,27-66,71-72H,1-2,23-26,67-70H2
• InChIKey: UKIFUSUXXJJNQN-UHFFFAOYSA-N
• XLogP: 27.19
• TPSA: 24.94 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 25
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1367.79
LogP ≤ 5	27.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine?

The IUPAC name of 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine (CID 139365391) is 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine.

What is the SMILES notation for 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine?

The canonical SMILES for 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine is C=Cc1ccc(OCCCCC2(c3ccccc3)c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc(N(c6ccc(-c7ccccc7)cc6)c6ccc7c(c6)C(CCCCOc6ccc(C=C)cc6)(c6ccccc6)c6ccccc6-7)c6ccccc56)cc4)cc32)cc1.

What is the InChIKey of 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine?

The InChIKey is UKIFUSUXXJJNQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C102H82N2O2/c1-3-73-41-59-87(60-42-73)105-69-25-23-67-101(80-31-13-7-14-32-80)96-39-21-19-36-91(96)93-63-57-85(71-98(93)101)103(82-51-45-77(46-52-82)75-27-9-5-10-28-75)83-55-49-79(50-56-83)89-65-66-100(95-38-18-17-35-90(89)95)104(84-53-47-78(48-54-84)76-29-11-6-12-30-76)86-58-64-94-92-37-20-22-40-97(92)102(99(94)72-86,81-33-15-8-16-34-81)68-24-26-70-106-88-61-43-74(4-2)44-62-88/h3-22,27-66,71-72H,1-2,23-26,67-70H2.

What are the key properties of 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine?

9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine has a molecular weight of 1367.79 g/mol, XLogP of 27.19, 25 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[4-(4-ethenylphenoxy)butyl]-N-[4-[4-(N-[9-[4-(4-ethenylphenoxy)butyl]-9-phenylfluoren-2-yl]-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine is sourced from PubChem (CID 139365391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).