N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine

C57H39N — CID 169019661

IUPACN-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccccc4-c4ccc(-c5cccc6ccccc56)cc4)c4cccc5ccccc45)cccc32)cc1
InChIInChI=1S/C57H39N/c1-3-22-44(23-4-1)57(45-24-5-2-6-25-45)51-31-13-11-29-50(51)56-52(57)32-17-35-55(56)58(54-34-16-21-41-19-8-10-27-48(41)54)53-33-14-12-28-49(53)43-38-36-42(37-39-43)47-30-15-20-40-18-7-9-26-46(40)47/h1-39H
InChIKeyHKHWJAGKESBACR-UHFFFAOYSA-N
MW737.95 g/mol
LogP15.16
Rot. Bonds7

About N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine

N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine (PubChem CID 169019661) has the molecular formula C57H39N and a molecular weight of 737.95 g/mol. Its IUPAC name is N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine.

Molecular Properties

Compound NameN-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
PubChem CID169019661
Molecular FormulaC57H39N
Molecular Weight737.95 g/mol
Exact Mass737.31
IUPAC NameN-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccccc4-c4ccc(-c5cccc6ccccc56)cc4)c4cccc5ccccc45)cccc32)cc1
InChIInChI=1S/C57H39N/c1-3-22-44(23-4-1)57(45-24-5-2-6-25-45)51-31-13-11-29-50(51)56-52(57)32-17-35-55(56)58(54-34-16-21-41-19-8-10-27-48(41)54)53-33-14-12-28-49(53)43-38-36-42(37-39-43)47-30-15-20-40-18-7-9-26-46(40)47/h1-39H
InChIKeyHKHWJAGKESBACR-UHFFFAOYSA-N
XLogP15.16
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500737.95
LogP ≤ 515.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 169019810
N-[2-(4-naphthalen-1-ylphenyl)phenyl]-N-[2-(4-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 169019649
N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(2-phenylphenyl)phenyl]fluoren-4-amine
CID 169020437
N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylnaphthalen-1-yl)phenyl]fluoren-4-amine
CID 139355192
N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenyl-N-[3-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 169019623
N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-4'-amine
CID 142481361
N-[4-(9,9-diphenylspiro[anthracene-10,9'-fluorene]-4'-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)naphthalen-1-amine
CID 142481230
N-(9,9-diphenylfluoren-4-yl)-10-(3-naphthalen-1-ylphenyl)-N-(2-phenylphenyl)phenanthren-9-amine
CID 155305081
2-(9,9-diphenylfluoren-4-yl)-N,N-bis(4-naphthalen-1-ylphenyl)aniline
CID 169020447
N-[3-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 169020517
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenyl-N-[3-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 169019953
N-(2-dibenzothiophen-3-ylphenyl)-N-naphthalen-1-yl-9,9-diphenylfluoren-4-amine
CID 167324703

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine?
The IUPAC name of N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine (CID 169019661) is N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine.
What is the SMILES notation for N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine?
The canonical SMILES for N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine is c1ccc(C2(c3ccccc3)c3ccccc3-c3c(N(c4ccccc4-c4ccc(-c5cccc6ccccc56)cc4)c4cccc5ccccc45)cccc32)cc1.
What is the InChIKey of N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine?
The InChIKey is HKHWJAGKESBACR-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H39N/c1-3-22-44(23-4-1)57(45-24-5-2-6-25-45)51-31-13-11-29-50(51)56-52(57)32-17-35-55(56)58(54-34-16-21-41-19-8-10-27-48(41)54)53-33-14-12-28-49(53)43-38-36-42(37-39-43)47-30-15-20-40-18-7-9-26-46(40)47/h1-39H.
What are the key properties of N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine?
N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine has a molecular weight of 737.95 g/mol, XLogP of 15.16, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine is sourced from PubChem (CID 169019661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).