8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine

C84H60N2O2 — CID 164934333

IUPAC8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)-c3ccccc3C4(C)C)c3cccc4oc5ccc(-c6ccccc6-c6cccc(-c7cccc(N(c8ccccc8)c8ccc(-c9ccc%10oc%11ccccc%11c%10c9)cc8)c7)c6)cc5c34)ccc21
InChIInChI=1S/C84H60N2O2/c1-83(2)73-30-13-10-27-66(73)69-51-62(41-43-75(69)83)86(63-42-44-76-70(52-63)67-28-11-14-31-74(67)84(76,3)4)77-32-18-34-81-82(77)72-50-58(38-46-80(72)88-81)65-26-9-8-25-64(65)57-21-16-19-54(47-57)55-20-17-24-61(48-55)85(59-22-6-5-7-23-59)60-39-35-53(36-40-60)56-37-45-79-71(49-56)68-29-12-15-33-78(68)87-79/h5-52H,1-4H3
InChIKeyMCDJMTYRGOTAEI-UHFFFAOYSA-N
MW1129.42 g/mol
LogP23.71
Rot. Bonds10

About 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine

8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine (PubChem CID 164934333) has the molecular formula C84H60N2O2 and a molecular weight of 1129.42 g/mol. Its IUPAC name is 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine.

Molecular Properties

Compound Name8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine
PubChem CID164934333
Molecular FormulaC84H60N2O2
Molecular Weight1129.42 g/mol
Exact Mass1128.47
IUPAC Name8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine
SMILESCC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)-c3ccccc3C4(C)C)c3cccc4oc5ccc(-c6ccccc6-c6cccc(-c7cccc(N(c8ccccc8)c8ccc(-c9ccc%10oc%11ccccc%11c%10c9)cc8)c7)c6)cc5c34)ccc21
InChIInChI=1S/C84H60N2O2/c1-83(2)73-30-13-10-27-66(73)69-51-62(41-43-75(69)83)86(63-42-44-76-70(52-63)67-28-11-14-31-74(67)84(76,3)4)77-32-18-34-81-82(77)72-50-58(38-46-80(72)88-81)65-26-9-8-25-64(65)57-21-16-19-54(47-57)55-20-17-24-61(48-55)85(59-22-6-5-7-23-59)60-39-35-53(36-40-60)56-37-45-79-71(49-56)68-29-12-15-33-78(68)87-79/h5-52H,1-4H3
InChIKeyMCDJMTYRGOTAEI-UHFFFAOYSA-N
XLogP23.71
TPSA32.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms88
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001129.42
LogP ≤ 523.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-3-amine
CID 67964223
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]-4-phenylaniline
CID 129085281
N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-N-[4-(3-phenylphenyl)phenyl]fluoren-3-amine;N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-3-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(3-phenylphenyl)phenyl]fluoren-3-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-3-amine
CID 159860584
N-(4-dibenzofuran-3-ylphenyl)-3-[3-(9,9-dimethylfluoren-3-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 168839418
N-(4-dibenzofuran-2-ylphenyl)-4-(9,9-dimethylfluoren-3-yl)-N-phenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-3-yl)phenyl]naphthalen-2-amine
CID 161220626
N-(3-dibenzofuran-1-ylphenyl)-N-[4-[4-(9,9-dimethylfluoren-3-yl)phenyl]phenyl]-3-phenylaniline
CID 168840030
N-(3-dibenzofuran-1-ylphenyl)-2-[2-(9,9-dimethylfluoren-3-yl)phenyl]-N-(3-phenylphenyl)aniline
CID 168839701
N-[3-(3-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-[3-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-[4-(3-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 161197514
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3,5-diphenylphenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 70808823
N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 67964274
5-bromo-1-N-dibenzofuran-2-yl-3-N-(9,9-dimethylfluoren-3-yl)-1-N-phenyl-3-N-(3-phenylphenyl)benzene-1,3-diamine
CID 122552103
N-(4-dibenzofuran-1-ylphenyl)-3-(9,9-dimethylfluoren-3-yl)-N-(4-phenylphenyl)aniline
CID 168840183

Frequently Asked Questions

What is the IUPAC name of 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine?
The IUPAC name of 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine (CID 164934333) is 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine.
What is the SMILES notation for 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine?
The canonical SMILES for 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine is CC1(C)c2ccccc2-c2cc(N(c3ccc4c(c3)-c3ccccc3C4(C)C)c3cccc4oc5ccc(-c6ccccc6-c6cccc(-c7cccc(N(c8ccccc8)c8ccc(-c9ccc%10oc%11ccccc%11c%10c9)cc8)c7)c6)cc5c34)ccc21.
What is the InChIKey of 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine?
The InChIKey is MCDJMTYRGOTAEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H60N2O2/c1-83(2)73-30-13-10-27-66(73)69-51-62(41-43-75(69)83)86(63-42-44-76-70(52-63)67-28-11-14-31-74(67)84(76,3)4)77-32-18-34-81-82(77)72-50-58(38-46-80(72)88-81)65-26-9-8-25-64(65)57-21-16-19-54(47-57)55-20-17-24-61(48-55)85(59-22-6-5-7-23-59)60-39-35-53(36-40-60)56-37-45-79-71(49-56)68-29-12-15-33-78(68)87-79/h5-52H,1-4H3.
What are the key properties of 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine?
8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine has a molecular weight of 1129.42 g/mol, XLogP of 23.71, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-[3-[3-(N-(4-dibenzofuran-2-ylphenyl)anilino)phenyl]phenyl]phenyl]-N,N-bis(9,9-dimethylfluoren-3-yl)dibenzofuran-1-amine is sourced from PubChem (CID 164934333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).