9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine

C75H51N — CID 121464369

IUPAC9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine
SMILESc1ccc(C2(c3ccc(N(c4ccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc4)c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C75H51N/c1-5-23-52(24-6-1)73(53-25-7-2-8-26-53)71-40-22-17-35-65(71)66-51-60(49-50-72(66)73)76(58-45-41-56(42-46-58)74(54-27-9-3-10-28-54)67-36-18-13-31-61(67)62-32-14-19-37-68(62)74)59-47-43-57(44-48-59)75(55-29-11-4-12-30-55)69-38-20-15-33-63(69)64-34-16-21-39-70(64)75/h1-51H
InChIKeyUIUOUNRWWLGEOP-UHFFFAOYSA-N
MW966.24 g/mol
LogP18.25
Rot. Bonds9

About 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine

9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine (PubChem CID 121464369) has the molecular formula C75H51N and a molecular weight of 966.24 g/mol. Its IUPAC name is 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine.

Molecular Properties

Compound Name9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine
PubChem CID121464369
Molecular FormulaC75H51N
Molecular Weight966.24 g/mol
Exact Mass965.40
IUPAC Name9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine
SMILESc1ccc(C2(c3ccc(N(c4ccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc4)c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C75H51N/c1-5-23-52(24-6-1)73(53-25-7-2-8-26-53)71-40-22-17-35-65(71)66-51-60(49-50-72(66)73)76(58-45-41-56(42-46-58)74(54-27-9-3-10-28-54)67-36-18-13-31-61(67)62-32-14-19-37-68(62)74)59-47-43-57(44-48-59)75(55-29-11-4-12-30-55)69-38-20-15-33-63(69)64-34-16-21-39-70(64)75/h1-51H
InChIKeyUIUOUNRWWLGEOP-UHFFFAOYSA-N
XLogP18.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms76
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500966.24
LogP ≤ 518.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine
CID 121423738
N,9,9-triphenyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-3'-amine
CID 146540179
N-(9,9-diphenylfluoren-3-yl)-N-[4-(3,5-diphenylphenyl)phenyl]-9,9'-spirobi[fluorene]-3-amine
CID 121423858
9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine;N-(9,9-diphenylfluoren-3-yl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine;N-(9,9-diphenylfluoren-3-yl)-9-methyl-9-phenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 158414467
N-[4-(9,9-diphenylfluoren-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 118155143
9-(4-methylphenyl)-N-[9-(4-methylphenyl)-9-phenylfluoren-3-yl]-9-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 177067075
N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-9,9-diphenyl-N-[4-(3-phenylphenyl)phenyl]fluoren-3-amine;N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-3-amine
CID 161038033
9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 121464320
N-(9,9-diphenylfluoren-3-yl)-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzothiophen-2-amine
CID 121381708
1-N,3-N,5-N-tris(9,9-diphenylfluoren-2-yl)-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
CID 132601190
9,9-dimethyl-N-[4-(9-phenylfluoren-9-yl)phenyl]-N-[3-(4-phenylphenyl)phenyl]fluoren-3-amine
CID 170375601
3-N,3-N,3-N',3-N'-tetrakis(4-phenylphenyl)-9,9'-spirobi[fluorene]-3,3'-diamine
CID 167236339

Frequently Asked Questions

What is the IUPAC name of 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine?
The IUPAC name of 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine (CID 121464369) is 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine.
What is the SMILES notation for 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine?
The canonical SMILES for 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine is c1ccc(C2(c3ccc(N(c4ccc(C5(c6ccccc6)c6ccccc6-c6ccccc65)cc4)c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine?
The InChIKey is UIUOUNRWWLGEOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H51N/c1-5-23-52(24-6-1)73(53-25-7-2-8-26-53)71-40-22-17-35-65(71)66-51-60(49-50-72(66)73)76(58-45-41-56(42-46-58)74(54-27-9-3-10-28-54)67-36-18-13-31-61(67)62-32-14-19-37-68(62)74)59-47-43-57(44-48-59)75(55-29-11-4-12-30-55)69-38-20-15-33-63(69)64-34-16-21-39-70(64)75/h1-51H.
What are the key properties of 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine?
9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine has a molecular weight of 966.24 g/mol, XLogP of 18.25, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine is sourced from PubChem (CID 121464369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).