N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine

C65H43NO — CID 140957021

IUPACN-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(C3c4ccccc4-c4cc(-c5cccc(-c6cccc(N(c7ccc8oc9ccccc9c8c7)c7cccc8ccccc78)c6)c5)ccc43)c2)cc1
InChIInChI=1S/C65H43NO/c1-3-16-43(17-4-1)50-37-51(44-18-5-2-6-19-44)39-52(38-50)65-58-29-10-9-27-56(58)60-41-49(32-34-59(60)65)47-23-13-22-46(36-47)48-24-14-25-53(40-48)66(62-30-15-21-45-20-7-8-26-55(45)62)54-33-35-64-61(42-54)57-28-11-12-31-63(57)67-64/h1-42,65H
InChIKeyMLZVSTVFQMTEEG-UHFFFAOYSA-N
MW854.07 g/mol
LogP18.04
Rot. Bonds8

About N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine

N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine (PubChem CID 140957021) has the molecular formula C65H43NO and a molecular weight of 854.07 g/mol. Its IUPAC name is N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine.

Molecular Properties

Compound NameN-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine
PubChem CID140957021
Molecular FormulaC65H43NO
Molecular Weight854.07 g/mol
Exact Mass853.33
IUPAC NameN-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine
SMILESc1ccc(-c2cc(-c3ccccc3)cc(C3c4ccccc4-c4cc(-c5cccc(-c6cccc(N(c7ccc8oc9ccccc9c8c7)c7cccc8ccccc78)c6)c5)ccc43)c2)cc1
InChIInChI=1S/C65H43NO/c1-3-16-43(17-4-1)50-37-51(44-18-5-2-6-19-44)39-52(38-50)65-58-29-10-9-27-56(58)60-41-49(32-34-59(60)65)47-23-13-22-46(36-47)48-24-14-25-53(40-48)66(62-30-15-21-45-20-7-8-26-55(45)62)54-33-35-64-61(42-54)57-28-11-12-31-63(57)67-64/h1-42,65H
InChIKeyMLZVSTVFQMTEEG-UHFFFAOYSA-N
XLogP18.04
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500854.07
LogP ≤ 518.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-dibenzofuran-2-yl-8-(9-phenyl-9H-fluoren-3-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 171448031
N-[4-[3-[4-(N-dibenzofuran-2-ylanilino)phenyl]-5-phenylphenyl]phenyl]-N-phenyldibenzofuran-2-amine;N,N-diphenyl-4-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline;N-[4-[4-[N-naphthalen-1-yl-4-[4-(N-naphthalen-1-ylanilino)phenyl]anilino]phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 165024004
N-phenyl-N-[3-(8-phenyldibenzofuran-2-yl)phenyl]naphthalen-1-amine
CID 121296588
4-[3,5-di(dibenzofuran-2-yl)phenyl]-N,N-diphenylaniline;N-[4-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]-N-phenylnaphthalen-1-amine;N-[4-[3,5-di(dibenzofuran-2-yl)phenyl]phenyl]-N-phenylnaphthalen-2-amine
CID 160762815
N-(2-dibenzofuran-2-ylphenyl)-N-[3-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-2-amine
CID 167325738
3-dibenzofuran-2-yl-N-[4-(3,5-diphenylphenyl)phenyl]-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline
CID 170535389
N-[4-[8-[4-(N-naphthalen-1-ylanilino)phenyl]dibenzofuran-2-yl]phenyl]-N-phenylnaphthalen-1-amine
CID 130438409
N-[4-[4-[dibenzofuran-4-yl(naphthalen-1-yl)amino]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-4-amine;N-naphthalen-1-yl-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]dibenzofuran-2-amine;N-naphthalen-1-yl-N-[4-[4-(N-[4-(4-phenylphenyl)phenyl]anilino)phenyl]phenyl]dibenzofuran-4-amine;N-naphthalen-1-yl-N-[4-[4-(4-phenyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]dibenzofuran-4-amine
CID 157350429
2-dibenzofuran-2-yl-N-(3-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)aniline
CID 167323911
N-naphthalen-1-yl-N-[2-[2-[2-(4-phenylphenyl)phenyl]phenyl]phenyl]dibenzofuran-2-amine
CID 172502268
N-(4-dibenzofuran-2-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-4-(4-phenylphenyl)aniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 157368464
N-(3-dibenzofuran-2-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]dibenzofuran-4-amine
CID 170535179

Frequently Asked Questions

What is the IUPAC name of N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine?
The IUPAC name of N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine (CID 140957021) is N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine.
What is the SMILES notation for N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine?
The canonical SMILES for N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine is c1ccc(-c2cc(-c3ccccc3)cc(C3c4ccccc4-c4cc(-c5cccc(-c6cccc(N(c7ccc8oc9ccccc9c8c7)c7cccc8ccccc78)c6)c5)ccc43)c2)cc1.
What is the InChIKey of N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine?
The InChIKey is MLZVSTVFQMTEEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H43NO/c1-3-16-43(17-4-1)50-37-51(44-18-5-2-6-19-44)39-52(38-50)65-58-29-10-9-27-56(58)60-41-49(32-34-59(60)65)47-23-13-22-46(36-47)48-24-14-25-53(40-48)66(62-30-15-21-45-20-7-8-26-55(45)62)54-33-35-64-61(42-54)57-28-11-12-31-63(57)67-64/h1-42,65H.
What are the key properties of N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine?
N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine has a molecular weight of 854.07 g/mol, XLogP of 18.04, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-[9-(3,5-diphenylphenyl)-9H-fluoren-3-yl]phenyl]phenyl]-N-naphthalen-1-yldibenzofuran-2-amine is sourced from PubChem (CID 140957021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).