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

C68H46N2 — CID 121381724

IUPACN-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine
SMILESc1ccc(C2(c3ccc(N(c4cccc(-n5c6ccccc6c6ccccc65)c4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C68H46N2/c1-4-22-47(23-5-1)67(59-35-15-10-30-54(59)55-31-11-16-36-60(55)67)50-42-44-51(45-43-50)69(52-28-20-29-53(46-52)70-63-39-18-13-32-56(63)57-33-14-19-40-64(57)70)65-41-21-38-62-66(65)58-34-12-17-37-61(58)68(62,48-24-6-2-7-25-48)49-26-8-3-9-27-49/h1-46H
InChIKeyOOLFGWCDHVNQGJ-UHFFFAOYSA-N
MW891.13 g/mol
LogP16.98
Rot. Bonds8

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

N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine (PubChem CID 121381724) has the molecular formula C68H46N2 and a molecular weight of 891.13 g/mol. Its IUPAC name is N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine.

Molecular Properties

Compound NameN-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine
PubChem CID121381724
Molecular FormulaC68H46N2
Molecular Weight891.13 g/mol
Exact Mass890.37
IUPAC NameN-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine
SMILESc1ccc(C2(c3ccc(N(c4cccc(-n5c6ccccc6c6ccccc65)c4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C68H46N2/c1-4-22-47(23-5-1)67(59-35-15-10-30-54(59)55-31-11-16-36-60(55)67)50-42-44-51(45-43-50)69(52-28-20-29-53(46-52)70-63-39-18-13-32-56(63)57-33-14-19-40-64(57)70)65-41-21-38-62-66(65)58-34-12-17-37-61(58)68(62,48-24-6-2-7-25-48)49-26-8-3-9-27-49/h1-46H
InChIKeyOOLFGWCDHVNQGJ-UHFFFAOYSA-N
XLogP16.98
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500891.13
LogP ≤ 516.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)-9,9'-spirobi[fluorene]-2-amine
CID 121423436
N-(3-carbazol-9-ylphenyl)-N-(9,9-diphenylfluoren-4-yl)dibenzothiophen-2-amine
CID 121424390
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 121424630
7-carbazol-9-yl-N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine
CID 135193232
7-carbazol-9-yl-N-(9,9-diphenylfluoren-2-yl)-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethylfluoren-2-amine
CID 135193235
N-(3-carbazol-9-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 121424239
N-(3-carbazol-9-ylphenyl)-N-[4-(4-dibenzofuran-2-ylphenyl)phenyl]-9,9-diphenylfluoren-4-amine
CID 121424581
N-(9,9-diphenylfluoren-4-yl)-9,9-diphenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-3-amine
CID 121423814
N-(9,9-diphenylfluoren-3-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-4-amine
CID 121423823
7-carbazol-9-yl-N-(9,9-diphenylfluoren-4-yl)-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 135193230
N-(3-carbazol-9-ylphenyl)-N-[2-(9,9-dimethylfluoren-4-yl)phenyl]-9,9-diphenylfluoren-3-amine
CID 170138490
N-(3-carbazol-9-ylphenyl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-diphenylfluoren-2-amine;N-(4-carbazol-9-ylphenyl)-N-[4-(9,9-diphenylfluoren-4-yl)phenyl]-9,9-diphenylfluoren-2-amine
CID 159606680

Frequently Asked Questions

What is the IUPAC name of N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine?
The IUPAC name of N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine (CID 121381724) is N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine.
What is the SMILES notation for N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine?
The canonical SMILES for N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine is c1ccc(C2(c3ccc(N(c4cccc(-n5c6ccccc6c6ccccc65)c4)c4cccc5c4-c4ccccc4C5(c4ccccc4)c4ccccc4)cc3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine?
The InChIKey is OOLFGWCDHVNQGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H46N2/c1-4-22-47(23-5-1)67(59-35-15-10-30-54(59)55-31-11-16-36-60(55)67)50-42-44-51(45-43-50)69(52-28-20-29-53(46-52)70-63-39-18-13-32-56(63)57-33-14-19-40-64(57)70)65-41-21-38-62-66(65)58-34-12-17-37-61(58)68(62,48-24-6-2-7-25-48)49-26-8-3-9-27-49/h1-46H.
What are the key properties of N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine?
N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine has a molecular weight of 891.13 g/mol, XLogP of 16.98, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-carbazol-9-ylphenyl)-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-4-amine is sourced from PubChem (CID 121381724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).