N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine

C61H40N2O — CID 129180885

IUPACN-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine
SMILESc1ccc(N(c2ccc3c(c2)oc2ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc23)c2cccc3c2-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C61H40N2O/c1-5-18-43(19-6-1)61(44-20-7-2-8-21-44)53-28-15-13-27-50(53)60-54(61)29-17-31-57(60)62(45-22-9-3-10-23-45)47-34-35-49-52-39-42(33-37-58(52)64-59(49)40-47)41-32-36-56-51(38-41)48-26-14-16-30-55(48)63(56)46-24-11-4-12-25-46/h1-40H
InChIKeyXGKGQQJOJWOMAR-UHFFFAOYSA-N
MW817.00 g/mol
LogP16.18
Rot. Bonds7

About N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine

N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine (PubChem CID 129180885) has the molecular formula C61H40N2O and a molecular weight of 817.00 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine.

Molecular Properties

Compound NameN-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine
PubChem CID129180885
Molecular FormulaC61H40N2O
Molecular Weight817.00 g/mol
Exact Mass816.31
IUPAC NameN-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine
SMILESc1ccc(N(c2ccc3c(c2)oc2ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc23)c2cccc3c2-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C61H40N2O/c1-5-18-43(19-6-1)61(44-20-7-2-8-21-44)53-28-15-13-27-50(53)60-54(61)29-17-31-57(60)62(45-22-9-3-10-23-45)47-34-35-49-52-39-42(33-37-58(52)64-59(49)40-47)41-32-36-56-51(38-41)48-26-14-16-30-55(48)63(56)46-24-11-4-12-25-46/h1-40H
InChIKeyXGKGQQJOJWOMAR-UHFFFAOYSA-N
XLogP16.18
TPSA21.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500817.00
LogP ≤ 516.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-carbazol-9-ylphenyl)-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 121424581
N-(4-carbazol-9-ylphenyl)-N-(4-dibenzofuran-3-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 121424440
N-(9,9-diphenylfluoren-4-yl)-9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-3-amine
CID 121423814
N,N-diphenyl-4-[4'-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-4-yl]aniline;N,9-diphenyl-N-[4-(7,9,9-triphenylfluoren-4-yl)phenyl]carbazol-3-amine;4-phenyl-N-(4-phenylphenyl)-N-[4-(4'-phenyl-9,9'-spirobi[fluorene]-2-yl)phenyl]aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-(4-phenyl-9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;N-(4-phenylphenyl)-N-[4-(4'-phenyl-9,9'-spirobi[fluorene]-2-yl)phenyl]dibenzofuran-3-amine;N-phenyl-N-[4-(7,9,9-triphenylfluoren-4-yl)phenyl]dibenzofuran-2-amine
CID 160866255
4-(9-dibenzofuran-2-ylfluoren-9-yl)-N,N-diphenylaniline;3-[3-(9-dibenzofuran-2-ylfluoren-9-yl)phenyl]-9-phenylcarbazole;2,3,4,5,6-pentadeuterio-N-(2,3,4,5,6-pentadeuteriophenyl)-N-[4-(9-phenylfluoren-9-yl)phenyl]aniline;N,9,9-triphenyl-N-(4-phenylphenyl)fluoren-4-amine
CID 160796403
N-(9,9-diphenylfluoren-3-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine
CID 121423823
N-(9,9-diphenylfluoren-3-yl)-N-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]dibenzofuran-3-amine
CID 129256023
N-dibenzofuran-3-yl-9-phenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]carbazol-3-amine
CID 129264393
N-(9,9-diphenylfluoren-2-yl)-N-[4-[3-[3-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]dibenzofuran-2-amine
CID 89426453
N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)naphtho[1,2-b][1]benzofuran-9-amine
CID 167277095
N-(4-carbazol-9-ylphenyl)-N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 121424255
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 121424630

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine?
The IUPAC name of N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine (CID 129180885) is N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine.
What is the SMILES notation for N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine?
The canonical SMILES for N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine is c1ccc(N(c2ccc3c(c2)oc2ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc23)c2cccc3c2-c2ccccc2C3(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine?
The InChIKey is XGKGQQJOJWOMAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H40N2O/c1-5-18-43(19-6-1)61(44-20-7-2-8-21-44)53-28-15-13-27-50(53)60-54(61)29-17-31-57(60)62(45-22-9-3-10-23-45)47-34-35-49-52-39-42(33-37-58(52)64-59(49)40-47)41-32-36-56-51(38-41)48-26-14-16-30-55(48)63(56)46-24-11-4-12-25-46/h1-40H.
What are the key properties of N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine?
N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine has a molecular weight of 817.00 g/mol, XLogP of 16.18, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-diphenylfluoren-4-yl)-N-phenyl-8-(9-phenylcarbazol-3-yl)dibenzofuran-3-amine is sourced from PubChem (CID 129180885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).