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

C73H50N2 — CID 170111185

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

9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine (PubChem CID 170111185) has the molecular formula C73H50N2 and a molecular weight of 955.22 g/mol. Its IUPAC name is 9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine.

Molecular Properties

• Compound Name: 9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine
• PubChem CID: 170111185
• Molecular Formula: C73H50N2
• Molecular Weight: 955.22 g/mol
• Exact Mass: 954.40
• IUPAC Name: 9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine
• SMILES: c1ccc(-c2ccccc2-c2ccccc2-c2ccccc2N(c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1
• InChI: InChI=1S/C73H50N2/c1-5-24-51(25-6-1)59-34-13-14-35-60(59)61-36-15-16-37-62(61)65-39-18-21-42-70(65)74(57-33-23-26-52(48-57)53-44-47-72-67(49-53)66-40-19-22-43-71(66)75(72)56-31-11-4-12-32-56)58-45-46-64-63-38-17-20-41-68(63)73(69(64)50-58,54-27-7-2-8-28-54)55-29-9-3-10-30-55/h1-50H
• InChIKey: VVWVJNPRUHWDGC-UHFFFAOYSA-N
• XLogP: 19.28
• TPSA: 8.17 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 10
• Heavy Atoms: 75
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	955.22
LogP ≤ 5	19.28
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

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

The IUPAC name of 9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine (CID 170111185) is 9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine.

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

The canonical SMILES for 9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine is c1ccc(-c2ccccc2-c2ccccc2-c2ccccc2N(c2cccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1.

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

The InChIKey is VVWVJNPRUHWDGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H50N2/c1-5-24-51(25-6-1)59-34-13-14-35-60(59)61-36-15-16-37-62(61)65-39-18-21-42-70(65)74(57-33-23-26-52(48-57)53-44-47-72-67(49-53)66-40-19-22-43-71(66)75(72)56-31-11-4-12-32-56)58-45-46-64-63-38-17-20-41-68(63)73(69(64)50-58,54-27-7-2-8-28-54)55-29-9-3-10-30-55/h1-50H.

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

9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine has a molecular weight of 955.22 g/mol, XLogP of 19.28, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 9,9-diphenyl-N-[3-(9-phenylcarbazol-3-yl)phenyl]-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]fluoren-2-amine is sourced from PubChem (CID 170111185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).