N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine

C75H51N — CID 121423738

IUPACN,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3cc(N(c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)ccc32)cc1
InChIInChI=1S/C75H51N/c1-7-25-52(26-8-1)73(53-27-9-2-10-28-53)67-40-22-19-37-61(67)64-49-58(43-46-70(64)73)76(59-44-47-71-65(50-59)62-38-20-23-41-68(62)74(71,54-29-11-3-12-30-54)55-31-13-4-14-32-55)60-45-48-72-66(51-60)63-39-21-24-42-69(63)75(72,56-33-15-5-16-34-56)57-35-17-6-18-36-57/h1-51H
InChIKeyDAFHVYACYMSCAV-UHFFFAOYSA-N
MW966.24 g/mol
LogP18.25
Rot. Bonds9

About N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine

N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine (PubChem CID 121423738) has the molecular formula C75H51N and a molecular weight of 966.24 g/mol. Its IUPAC name is N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine.

Molecular Properties

Compound NameN,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine
PubChem CID121423738
Molecular FormulaC75H51N
Molecular Weight966.24 g/mol
Exact Mass965.40
IUPAC NameN,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3cc(N(c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)ccc32)cc1
InChIInChI=1S/C75H51N/c1-7-25-52(26-8-1)73(53-27-9-2-10-28-53)67-40-22-19-37-61(67)64-49-58(43-46-70(64)73)76(59-44-47-71-65(50-59)62-38-20-23-41-68(62)74(71,54-29-11-3-12-30-54)55-31-13-4-14-32-55)60-45-48-72-66(51-60)63-39-21-24-42-69(63)75(72,56-33-15-5-16-34-56)57-35-17-6-18-36-57/h1-51H
InChIKeyDAFHVYACYMSCAV-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

9,9-diphenyl-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-3-amine
CID 121464369
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
N-(9,9-diphenylfluoren-3-yl)-N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine
CID 121423646
N-[4-(9,9-diphenylfluoren-3-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 118155143
N-(9,9-diphenylfluoren-3-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-diphenylfluoren-3-amine
CID 121423447
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
N-(9,9-diphenylfluoren-3-yl)-9,9-diphenyl-N-[3-(3-phenylphenyl)phenyl]fluoren-2-amine
CID 121423591
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
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
3-(9,9-diphenylfluoren-3-yl)-N-[3-(9,9-diphenylfluoren-3-yl)phenyl]-N-phenylaniline
CID 162510737
N,N-bis[3-(9,9-diphenylfluoren-3-yl)phenyl]-3-phenylaniline
CID 162510714

Frequently Asked Questions

What is the IUPAC name of N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine?
The IUPAC name of N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine (CID 121423738) is N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine.
What is the SMILES notation for N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine?
The canonical SMILES for N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine is c1ccc(C2(c3ccccc3)c3ccccc3-c3cc(N(c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)ccc32)cc1.
What is the InChIKey of N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine?
The InChIKey is DAFHVYACYMSCAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C75H51N/c1-7-25-52(26-8-1)73(53-27-9-2-10-28-53)67-40-22-19-37-61(67)64-49-58(43-46-70(64)73)76(59-44-47-71-65(50-59)62-38-20-23-41-68(62)74(71,54-29-11-3-12-30-54)55-31-13-4-14-32-55)60-45-48-72-66(51-60)63-39-21-24-42-69(63)75(72,56-33-15-5-16-34-56)57-35-17-6-18-36-57/h1-51H.
What are the key properties of N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine?
N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-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 N,N-bis(9,9-diphenylfluoren-3-yl)-9,9-diphenylfluoren-3-amine is sourced from PubChem (CID 121423738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).