N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine

C91H57NO3 — CID 176760020

IUPACN-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
SMILESc1ccc(-c2ccc3oc4cccc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5cccc(N(c6cccc7oc8ccc(-c9ccccc9)cc8c67)c6cccc7oc8ccc(-c9c(-c%10ccccc%10)cccc9-c9ccccc9)cc8c67)c5)c4c3c2)cc1
InChIInChI=1S/C91H57NO3/c1-6-24-58(25-7-1)62-48-51-80-73(54-62)88-71(40-21-45-83(88)93-80)70-39-20-42-77-87(70)72-36-16-17-41-76(72)91(77,65-32-14-5-15-33-65)66-34-18-35-67(57-66)92(78-43-22-46-84-89(78)74-55-63(49-52-81(74)94-84)59-26-8-2-9-27-59)79-44-23-47-85-90(79)75-56-64(50-53-82(75)95-85)86-68(60-28-10-3-11-29-60)37-19-38-69(86)61-30-12-4-13-31-61/h1-57H
InChIKeyHVHZERFNKCXIOP-UHFFFAOYSA-N
MW1212.46 g/mol
LogP25.22
Rot. Bonds11

About N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine

N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine (PubChem CID 176760020) has the molecular formula C91H57NO3 and a molecular weight of 1212.46 g/mol. Its IUPAC name is N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine.

Molecular Properties

Compound NameN-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
PubChem CID176760020
Molecular FormulaC91H57NO3
Molecular Weight1212.46 g/mol
Exact Mass1211.43
IUPAC NameN-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
SMILESc1ccc(-c2ccc3oc4cccc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5cccc(N(c6cccc7oc8ccc(-c9ccccc9)cc8c67)c6cccc7oc8ccc(-c9c(-c%10ccccc%10)cccc9-c9ccccc9)cc8c67)c5)c4c3c2)cc1
InChIInChI=1S/C91H57NO3/c1-6-24-58(25-7-1)62-48-51-80-73(54-62)88-71(40-21-45-83(88)93-80)70-39-20-42-77-87(70)72-36-16-17-41-76(72)91(77,65-32-14-5-15-33-65)66-34-18-35-67(57-66)92(78-43-22-46-84-89(78)74-55-63(49-52-81(74)94-84)59-26-8-2-9-27-59)79-44-23-47-85-90(79)75-56-64(50-53-82(75)95-85)86-68(60-28-10-3-11-29-60)37-19-38-69(86)61-30-12-4-13-31-61/h1-57H
InChIKeyHVHZERFNKCXIOP-UHFFFAOYSA-N
XLogP25.22
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms95
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001212.46
LogP ≤ 525.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine with MolForge

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Related Compounds

N-(8-phenyldibenzofuran-1-yl)-N-[3-(9-phenylfluoren-9-yl)phenyl]spiro[fluorene-9,9'-xanthene]-4-amine
CID 176759987
N-[3-(4,9-diphenylfluoren-9-yl)phenyl]-9-phenyl-N-(9-phenyldibenzofuran-2-yl)dibenzofuran-2-amine
CID 176760030
N-(9,9-dimethyl-5-phenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759880
N-(3-dibenzofuran-2-ylphenyl)-N-[2-(9,9-diphenylfluoren-4-yl)phenyl]-2-(4-phenylphenyl)aniline
CID 161297383
N-(4-dibenzofuran-1-ylphenyl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759950
N-(9,9-diphenylfluoren-2-yl)-8-phenyl-N-[3-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759723
8-phenyl-N-(3-phenylphenyl)-N-[4-[9-(3-phenylphenyl)fluoren-9-yl]phenyl]dibenzofuran-1-amine
CID 176759838
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-3-(4-phenylphenyl)aniline
CID 159899599
N-[3-(4,9-diphenylfluoren-9-yl)phenyl]-N-(4-phenylphenyl)-9-pyridin-3-yldibenzofuran-2-amine
CID 176760070
8-phenyl-N-(9-phenyldibenzothiophen-2-yl)-N-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-1-amine
CID 170045111
N-[2-(4-cyclohexylphenyl)phenyl]-8-phenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-1-amine
CID 176759731
N-[8-[4-(1-adamantyl)phenyl]dibenzofuran-1-yl]-9-phenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-2-amine
CID 176759710

Frequently Asked Questions

What is the IUPAC name of N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine?
The IUPAC name of N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine (CID 176760020) is N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine.
What is the SMILES notation for N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine?
The canonical SMILES for N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine is c1ccc(-c2ccc3oc4cccc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5cccc(N(c6cccc7oc8ccc(-c9ccccc9)cc8c67)c6cccc7oc8ccc(-c9c(-c%10ccccc%10)cccc9-c9ccccc9)cc8c67)c5)c4c3c2)cc1.
What is the InChIKey of N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine?
The InChIKey is HVHZERFNKCXIOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C91H57NO3/c1-6-24-58(25-7-1)62-48-51-80-73(54-62)88-71(40-21-45-83(88)93-80)70-39-20-42-77-87(70)72-36-16-17-41-76(72)91(77,65-32-14-5-15-33-65)66-34-18-35-67(57-66)92(78-43-22-46-84-89(78)74-55-63(49-52-81(74)94-84)59-26-8-2-9-27-59)79-44-23-47-85-90(79)75-56-64(50-53-82(75)95-85)86-68(60-28-10-3-11-29-60)37-19-38-69(86)61-30-12-4-13-31-61/h1-57H.
What are the key properties of N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine?
N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine has a molecular weight of 1212.46 g/mol, XLogP of 25.22, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[8-(2,6-diphenylphenyl)dibenzofuran-1-yl]-8-phenyl-N-[3-[9-phenyl-4-(8-phenyldibenzofuran-1-yl)fluoren-9-yl]phenyl]dibenzofuran-1-amine is sourced from PubChem (CID 176760020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).