9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine

C65H43N — CID 169019816

IUPAC9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine
SMILESc1ccc2c(c1)-c1c(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cccc5ccccc45)cc3)cccc1C2(c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C65H43N/c1-5-24-52-44(16-1)20-11-29-54(52)48-36-40-50(41-37-48)66(51-42-38-49(39-43-51)55-30-12-21-45-17-2-6-25-53(45)55)63-35-15-34-62-64(63)58-28-9-10-31-61(58)65(62,59-32-13-22-46-18-3-7-26-56(46)59)60-33-14-23-47-19-4-8-27-57(47)60/h1-43H
InChIKeyUWQIQCKBPCCLCB-UHFFFAOYSA-N
MW838.07 g/mol
LogP17.47
Rot. Bonds7

About 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine

9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine (PubChem CID 169019816) has the molecular formula C65H43N and a molecular weight of 838.07 g/mol. Its IUPAC name is 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine.

Molecular Properties

Compound Name9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine
PubChem CID169019816
Molecular FormulaC65H43N
Molecular Weight838.07 g/mol
Exact Mass837.34
IUPAC Name9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine
SMILESc1ccc2c(c1)-c1c(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cccc5ccccc45)cc3)cccc1C2(c1cccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C65H43N/c1-5-24-52-44(16-1)20-11-29-54(52)48-36-40-50(41-37-48)66(51-42-38-49(39-43-51)55-30-12-21-45-17-2-6-25-53(45)55)63-35-15-34-62-64(63)58-28-9-10-31-61(58)65(62,59-32-13-22-46-18-3-7-26-56(46)59)60-33-14-23-47-19-4-8-27-57(47)60/h1-43H
InChIKeyUWQIQCKBPCCLCB-UHFFFAOYSA-N
XLogP17.47
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500838.07
LogP ≤ 517.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-naphthalen-1-ylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-4'-amine
CID 142481361
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
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-[2-[2-(2-phenylphenyl)phenyl]phenyl]spiro[anthracene-10,9'-fluorene]-4'-amine
CID 170117389
N-(4-dibenzofuran-4-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-9,9'-spirobi[fluorene]-4-amine
CID 170421476
N-(4-naphthalen-1-ylphenyl)-N-phenyl-4-[2-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline
CID 156524799
N-[2-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 169019810
N-phenyl-N-[4-(2-phenylnaphthalen-1-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine
CID 139355095
N-[4-(9,9-diphenylspiro[anthracene-10,9'-fluorene]-4'-yl)phenyl]-N-(4-naphthalen-1-ylphenyl)naphthalen-1-amine
CID 142481230
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-(4-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 169020362
N-[4-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenyl-N-[3-(4-phenylphenyl)phenyl]fluoren-4-amine
CID 169019953
N-[3-(4-naphthalen-1-ylphenyl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 169020517

Frequently Asked Questions

What is the IUPAC name of 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine?
The IUPAC name of 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine (CID 169019816) is 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine.
What is the SMILES notation for 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine?
The canonical SMILES for 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine is c1ccc2c(c1)-c1c(N(c3ccc(-c4cccc5ccccc45)cc3)c3ccc(-c4cccc5ccccc45)cc3)cccc1C2(c1cccc2ccccc12)c1cccc2ccccc12.
What is the InChIKey of 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine?
The InChIKey is UWQIQCKBPCCLCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H43N/c1-5-24-52-44(16-1)20-11-29-54(52)48-36-40-50(41-37-48)66(51-42-38-49(39-43-51)55-30-12-21-45-17-2-6-25-53(45)55)63-35-15-34-62-64(63)58-28-9-10-31-61(58)65(62,59-32-13-22-46-18-3-7-26-56(46)59)60-33-14-23-47-19-4-8-27-57(47)60/h1-43H.
What are the key properties of 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine?
9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine has a molecular weight of 838.07 g/mol, XLogP of 17.47, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dinaphthalen-1-yl-N,N-bis(4-naphthalen-1-ylphenyl)fluoren-4-amine is sourced from PubChem (CID 169019816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).