N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine

C64H45NO — CID 163575580

IUPACN-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
SMILESCC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc4c(c3)Cc3cc(-c5ccc6oc7ccccc7c6c5)ccc3-4)cc21
InChIInChI=1S/C64H45NO/c1-64(2)60-39-48(42-13-7-4-8-14-42)24-31-56(60)57-33-29-53(40-61(57)64)65(51-26-21-45(22-27-51)44-19-17-43(18-20-44)41-11-5-3-6-12-41)52-28-32-55-50(37-52)36-49-35-46(23-30-54(49)55)47-25-34-63-59(38-47)58-15-9-10-16-62(58)66-63/h3-35,37-40H,36H2,1-2H3
InChIKeyGDEISYPGSWSDDH-UHFFFAOYSA-N
MW844.07 g/mol
LogP17.60
Rot. Bonds7

About N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine

N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine (PubChem CID 163575580) has the molecular formula C64H45NO and a molecular weight of 844.07 g/mol. Its IUPAC name is N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine.

Molecular Properties

Compound NameN-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
PubChem CID163575580
Molecular FormulaC64H45NO
Molecular Weight844.07 g/mol
Exact Mass843.35
IUPAC NameN-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
SMILESCC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc4c(c3)Cc3cc(-c5ccc6oc7ccccc7c6c5)ccc3-4)cc21
InChIInChI=1S/C64H45NO/c1-64(2)60-39-48(42-13-7-4-8-14-42)24-31-56(60)57-33-29-53(40-61(57)64)65(51-26-21-45(22-27-51)44-19-17-43(18-20-44)41-11-5-3-6-12-41)52-28-32-55-50(37-52)36-49-35-46(23-30-54(49)55)47-25-34-63-59(38-47)58-15-9-10-16-62(58)66-63/h3-35,37-40H,36H2,1-2H3
InChIKeyGDEISYPGSWSDDH-UHFFFAOYSA-N
XLogP17.60
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms66
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500844.07
LogP ≤ 517.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-bis(4-dibenzofuran-2-ylphenyl)-4-(4-phenylphenyl)aniline;7-dibenzofuran-2-yl-9,9-dimethyl-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 159384887
N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-N,7-diphenylfluoren-2-amine
CID 67964088
N-[4-[4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]phenyl]phenyl]-9,9-dimethyl-N,7-diphenylfluoren-2-amine
CID 67964102
7-dibenzofuran-2-yl-9,9-dimethyl-N,N-bis[4-(3-phenylphenyl)phenyl]fluoren-2-amine;7-dibenzofuran-2-yl-9,9-dimethyl-N,N-bis[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 157073472
N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-7-phenylfluoren-2-amine;N,N-bis(4-dibenzofuran-2-ylphenyl)-4-(4-phenylphenyl)aniline;4-dibenzofuran-2-yl-N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 159396574
N,N-bis(4-dibenzofuran-2-ylphenyl)-4-[4-(4-dibenzofuran-2-ylphenyl)phenyl]aniline;4-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)aniline;7-dibenzofuran-2-yl-N,N-bis(4-dibenzofuran-2-ylphenyl)-9,9-dimethylfluoren-2-amine;N,N,4-tris(4-dibenzofuran-2-ylphenyl)aniline
CID 158947437
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-7-phenylfluoren-2-amine
CID 67964328
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-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 67964274
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3,5-diphenylphenyl)phenyl]-9,9-dimethylfluoren-2-amine
CID 70808823
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethyl-7-phenylfluoren-2-yl)-9,9-dimethyl-7-phenylfluoren-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine;N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 157298586
7-[5-(4-dibenzofuran-2-ylphenyl)thiophen-2-yl]-9,9-dimethyl-N,N-bis(4-phenylphenyl)fluoren-2-amine;N-[4-[5-(4-dibenzofuran-2-ylphenyl)thiophen-2-yl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-[4-[5-(4-dibenzofuran-2-ylphenyl)thiophen-2-yl]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 159025107

Frequently Asked Questions

What is the IUPAC name of N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?
The IUPAC name of N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine (CID 163575580) is N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine.
What is the SMILES notation for N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?
The canonical SMILES for N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine is CC1(C)c2cc(-c3ccccc3)ccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc4c(c3)Cc3cc(-c5ccc6oc7ccccc7c6c5)ccc3-4)cc21.
What is the InChIKey of N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?
The InChIKey is GDEISYPGSWSDDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H45NO/c1-64(2)60-39-48(42-13-7-4-8-14-42)24-31-56(60)57-33-29-53(40-61(57)64)65(51-26-21-45(22-27-51)44-19-17-43(18-20-44)41-11-5-3-6-12-41)52-28-32-55-50(37-52)36-49-35-46(23-30-54(49)55)47-25-34-63-59(38-47)58-15-9-10-16-62(58)66-63/h3-35,37-40H,36H2,1-2H3.
What are the key properties of N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?
N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine has a molecular weight of 844.07 g/mol, XLogP of 17.60, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-dibenzofuran-2-yl-9H-fluoren-2-yl)-9,9-dimethyl-7-phenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine is sourced from PubChem (CID 163575580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).