N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine

C67H46N2 — CID 118505787

IUPACN,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccccc6N(c6ccccc6)c6ccc7c(c6)-c6ccccc6C7(c6ccccc6)c6ccccc6)c5)cc43)c2)cc1
InChIInChI=1S/C67H46N2/c1-5-21-47(22-6-1)49-24-20-32-55(44-49)69-65-38-18-15-35-59(65)60-41-39-50(45-66(60)69)48-23-19-25-51(43-48)57-33-14-17-37-64(57)68(54-30-11-4-12-31-54)56-40-42-63-61(46-56)58-34-13-16-36-62(58)67(63,52-26-7-2-8-27-52)53-28-9-3-10-29-53/h1-46H
InChIKeyMAUFAGNEBZFYIN-UHFFFAOYSA-N
MW879.12 g/mol
LogP17.62
Rot. Bonds9

About N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine

N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine (PubChem CID 118505787) has the molecular formula C67H46N2 and a molecular weight of 879.12 g/mol. Its IUPAC name is N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine.

Molecular Properties

Compound NameN,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
PubChem CID118505787
Molecular FormulaC67H46N2
Molecular Weight879.12 g/mol
Exact Mass878.37
IUPAC NameN,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
SMILESc1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccccc6N(c6ccccc6)c6ccc7c(c6)-c6ccccc6C7(c6ccccc6)c6ccccc6)c5)cc43)c2)cc1
InChIInChI=1S/C67H46N2/c1-5-21-47(22-6-1)49-24-20-32-55(44-49)69-65-38-18-15-35-59(65)60-41-39-50(45-66(60)69)48-23-19-25-51(43-48)57-33-14-17-37-64(57)68(54-30-11-4-12-31-54)56-40-42-63-61(46-56)58-34-13-16-36-62(58)67(63,52-26-7-2-8-27-52)53-28-9-3-10-29-53/h1-46H
InChIKeyMAUFAGNEBZFYIN-UHFFFAOYSA-N
XLogP17.62
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms69
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500879.12
LogP ≤ 517.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,9,9-triphenyl-N-[4-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
CID 118505705
2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 118265716
2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N,N-diphenylaniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(3-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-(4-phenylphenyl)aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(2-phenylphenyl)phenyl]aniline;2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline;N-[2-[4-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline
CID 161329368
N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-3-yl]phenyl]phenyl]fluoren-2-amine
CID 118462520
N,N-bis(4-phenylphenyl)-2-[3-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]aniline;N-[2-[3-(6,9-diphenylcarbazol-2-yl)phenyl]phenyl]-N,9,9-triphenylfluoren-2-amine;2-[3-(9-phenylcarbazol-2-yl)phenyl]-N,N-bis(4-phenylphenyl)aniline;N,9,9-triphenyl-N-[2-[3-[6-phenyl-9-(4-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-2-amine
CID 157435887
9,9-diphenyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-3-amine
CID 138667407
9,9-bis(4-methylphenyl)-N-phenyl-N-[2-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]fluoren-2-amine
CID 118505785
2-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]-N,N-bis(3-phenylphenyl)aniline;N-[2-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine;N-[2-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 161069792
N-[4-(3-carbazol-9-ylphenyl)phenyl]-N-(9,9-diphenylfluoren-3-yl)-9,9'-spirobi[fluorene]-2-amine;N-(9,9-diphenylfluoren-3-yl)-N-[4-(4-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-4-amine;N-(9,9-diphenylfluoren-3-yl)-N-(2-phenylphenyl)-9,9'-spirobi[fluorene]-4-amine;N-(9,9-diphenylfluoren-3-yl)-N-(3-phenylphenyl)-9,9'-spirobi[fluorene]-4-amine;N-(9,9-diphenylfluoren-3-yl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-4-amine;N-(9,9-diphenylfluoren-3-yl)-N-phenyl-9,9'-spirobi[fluorene]-4-amine
CID 159801744
N-naphthalen-1-yl-9,9-diphenyl-N-[3-[9-[3-(3-phenylphenyl)phenyl]carbazol-2-yl]phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[3-[9-[4-(2-phenylphenyl)phenyl]carbazol-2-yl]phenyl]naphthalen-1-amine;3-phenyl-N-(3-phenylphenyl)-N-[3-[9-[3-(2-phenylphenyl)phenyl]carbazol-2-yl]phenyl]aniline
CID 158858798
9,9-diphenyl-N-[3-[3-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine
CID 118505688
4-[3-[9-(9,9-diphenylfluoren-2-yl)carbazol-2-yl]phenyl]-N,N-diphenylaniline
CID 118505684

Frequently Asked Questions

What is the IUPAC name of N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine?
The IUPAC name of N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine (CID 118505787) is N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine.
What is the SMILES notation for N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine?
The canonical SMILES for N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine is c1ccc(-c2cccc(-n3c4ccccc4c4ccc(-c5cccc(-c6ccccc6N(c6ccccc6)c6ccc7c(c6)-c6ccccc6C7(c6ccccc6)c6ccccc6)c5)cc43)c2)cc1.
What is the InChIKey of N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine?
The InChIKey is MAUFAGNEBZFYIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C67H46N2/c1-5-21-47(22-6-1)49-24-20-32-55(44-49)69-65-38-18-15-35-59(65)60-41-39-50(45-66(60)69)48-23-19-25-51(43-48)57-33-14-17-37-64(57)68(54-30-11-4-12-31-54)56-40-42-63-61(46-56)58-34-13-16-36-62(58)67(63,52-26-7-2-8-27-52)53-28-9-3-10-29-53/h1-46H.
What are the key properties of N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine?
N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine has a molecular weight of 879.12 g/mol, XLogP of 17.62, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine is sourced from PubChem (CID 118505787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).