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

C60H41N — CID 121464393

IUPACN-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine
SMILESc1ccc(C2(c3ccc(N(c4ccc5ccccc5c4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C60H41N/c1-4-21-44(22-5-1)59(53-30-15-12-27-50(53)51-28-13-16-31-54(51)59)47-36-39-48(40-37-47)61(49-38-35-42-19-10-11-20-43(42)41-49)57-34-18-33-56-58(57)52-29-14-17-32-55(52)60(56,45-23-6-2-7-24-45)46-25-8-3-9-26-46/h1-41H
InChIKeyAGUURKLOEZBFJB-UHFFFAOYSA-N
MW776.00 g/mol
LogP15.04
Rot. Bonds7

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

N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine (PubChem CID 121464393) has the molecular formula C60H41N and a molecular weight of 776.00 g/mol. Its IUPAC name is N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine
PubChem CID121464393
Molecular FormulaC60H41N
Molecular Weight776.00 g/mol
Exact Mass775.32
IUPAC NameN-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine
SMILESc1ccc(C2(c3ccc(N(c4ccc5ccccc5c4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C60H41N/c1-4-21-44(22-5-1)59(53-30-15-12-27-50(53)51-28-13-16-31-54(51)59)47-36-39-48(40-37-47)61(49-38-35-42-19-10-11-20-43(42)41-49)57-34-18-33-56-58(57)52-29-14-17-32-55(52)60(56,45-23-6-2-7-24-45)46-25-8-3-9-26-46/h1-41H
InChIKeyAGUURKLOEZBFJB-UHFFFAOYSA-N
XLogP15.04
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500776.00
LogP ≤ 515.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(9,9-diphenylfluoren-4-yl)-N-(4-phenylphenyl)pentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(20),2(11),3,5,7,9,12,14,16,18-decaen-6-amine
CID 166031981
N-(4-naphthalen-2-ylphenyl)-N-[3-(4-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 169019576
N-(3-naphthalen-2-ylphenyl)-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 167271873
9,9-diphenyl-N-(4-phenylphenyl)-N-[7-(4-phenylphenyl)naphthalen-2-yl]fluoren-4-amine
CID 166497792
N-(9,9-diphenylfluoren-3-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-3-amine
CID 121423447
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 121464380
N-[2-(4-naphthalen-2-ylphenyl)phenyl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 169020516
N-(9,9-diphenylfluoren-4-yl)-N-(4-methoxyphenyl)-9,9-diphenylfluoren-2-amine
CID 121423384
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(2-phenylphenyl)phenyl]fluoren-4-amine
CID 121464379
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 169020362
2-(9,9-diphenylfluoren-4-yl)-N,N-bis(4-naphthalen-2-ylphenyl)aniline
CID 169019616
N-[4-[4-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-9,9-diphenyl-N-[2-(3-phenylphenyl)phenyl]fluoren-4-amine
CID 166566442

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine?
The IUPAC name of N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine (CID 121464393) is N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine.
What is the SMILES notation for N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine?
The canonical SMILES for N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine is c1ccc(C2(c3ccc(N(c4ccc5ccccc5c4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine?
The InChIKey is AGUURKLOEZBFJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H41N/c1-4-21-44(22-5-1)59(53-30-15-12-27-50(53)51-28-13-16-31-54(51)59)47-36-39-48(40-37-47)61(49-38-35-42-19-10-11-20-43(42)41-49)57-34-18-33-56-58(57)52-29-14-17-32-55(52)60(56,45-23-6-2-7-24-45)46-25-8-3-9-26-46/h1-41H.
What are the key properties of N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine?
N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine has a molecular weight of 776.00 g/mol, XLogP of 15.04, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine is sourced from PubChem (CID 121464393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).