N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine

C65H44N2 — CID 90393429

About N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine

N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine (PubChem CID 90393429) has the molecular formula C65H44N2 and a molecular weight of 853.08 g/mol. Its IUPAC name is N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine.

Molecular Properties

• Compound Name: N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
• PubChem CID: 90393429
• Molecular Formula: C65H44N2
• Molecular Weight: 853.08 g/mol
• Exact Mass: 852.35
• IUPAC Name: N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine
• SMILES: c1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5ccc(N(c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c6cccc7ccccc67)cc5)c4)ccc32)cc1
• InChI: InChI=1S/C65H44N2/c1-4-22-50(23-5-1)65(51-24-6-2-7-25-51)60-31-14-12-29-56(60)57-40-39-54(44-61(57)65)66(62-33-17-19-46-18-10-11-28-55(46)62)53-37-34-45(35-38-53)47-20-16-21-48(42-47)49-36-41-64-59(43-49)58-30-13-15-32-63(58)67(64)52-26-8-3-9-27-52/h1-44H
• InChIKey: YONORDXRWNLOJY-UHFFFAOYSA-N
• XLogP: 17.10
• TPSA: 8.17 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 8
• Heavy Atoms: 67
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	853.08
LogP ≤ 5	17.10
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine?

The IUPAC name of N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine (CID 90393429) is N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine.

What is the SMILES notation for N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine?

The canonical SMILES for N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine is c1ccc(-n2c3ccccc3c3cc(-c4cccc(-c5ccc(N(c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c6cccc7ccccc67)cc5)c4)ccc32)cc1.

What is the InChIKey of N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine?

The InChIKey is YONORDXRWNLOJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H44N2/c1-4-22-50(23-5-1)65(51-24-6-2-7-25-51)60-31-14-12-29-56(60)57-40-39-54(44-61(57)65)66(62-33-17-19-46-18-10-11-28-55(46)62)53-37-34-45(35-38-53)47-20-16-21-48(42-47)49-36-41-64-59(43-49)58-30-13-15-32-63(58)67(64)52-26-8-3-9-27-52/h1-44H.

What are the key properties of N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine?

N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine has a molecular weight of 853.08 g/mol, XLogP of 17.10, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-naphthalen-1-yl-9,9-diphenyl-N-[4-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine is sourced from PubChem (CID 90393429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).