2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline

C73H50N2 — CID 118265642

IUPAC2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4-c4ccc(-c5ccc6c7ccccc7n(-c7cccc8c7-c7ccccc7C8(c7ccccc7)c7ccccc7)c6c5)cc4)cc3)cc2)cc1
InChIInChI=1S/C73H50N2/c1-5-20-51(21-6-1)52-36-38-53(39-37-52)54-44-47-61(48-45-54)74(60-26-11-4-12-27-60)68-33-17-14-28-62(68)56-42-40-55(41-43-56)57-46-49-64-63-29-15-18-34-69(63)75(71(64)50-57)70-35-19-32-67-72(70)65-30-13-16-31-66(65)73(67,58-22-7-2-8-23-58)59-24-9-3-10-25-59/h1-50H
InChIKeyLOTXKMGICWXGOW-UHFFFAOYSA-N
MW955.22 g/mol
LogP19.28
Rot. Bonds10

About 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline

2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline (PubChem CID 118265642) has the molecular formula C73H50N2 and a molecular weight of 955.22 g/mol. Its IUPAC name is 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline.

Molecular Properties

Compound Name2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
PubChem CID118265642
Molecular FormulaC73H50N2
Molecular Weight955.22 g/mol
Exact Mass954.40
IUPAC Name2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4-c4ccc(-c5ccc6c7ccccc7n(-c7cccc8c7-c7ccccc7C8(c7ccccc7)c7ccccc7)c6c5)cc4)cc3)cc2)cc1
InChIInChI=1S/C73H50N2/c1-5-20-51(21-6-1)52-36-38-53(39-37-52)54-44-47-61(48-45-54)74(60-26-11-4-12-27-60)68-33-17-14-28-62(68)56-42-40-55(41-43-56)57-46-49-64-63-29-15-18-34-69(63)75(71(64)50-57)70-35-19-32-67-72(70)65-30-13-16-31-66(65)73(67,58-22-7-2-8-23-58)59-24-9-3-10-25-59/h1-50H
InChIKeyLOTXKMGICWXGOW-UHFFFAOYSA-N
XLogP19.28
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms75
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500955.22
LogP ≤ 519.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline
CID 118265653
3-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline
CID 118349357
3-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 118349359
3-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]-N-phenyl-N-[4-(2-phenylphenyl)phenyl]aniline
CID 118349360
N-[4-[2-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]phenyl]-N,3,4-triphenylaniline
CID 118337172
2-[4-[9-(9,9-diphenylfluoren-3-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(3-phenylphenyl)phenyl]aniline
CID 118265716
N-[3-[2-[9-(9,9-diphenylfluoren-1-yl)carbazol-2-yl]phenyl]phenyl]-N-naphthalen-1-yl-9,9-diphenylfluoren-2-amine;N-[3-[2-[9-(9,9-diphenylfluoren-1-yl)carbazol-2-yl]phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-1-amine;N-[3-[2-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]phenyl]-3-phenyl-N-(3-phenylphenyl)aniline;N-[3-[2-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 159417227
N-[4-(2-carbazol-9-ylphenyl)phenyl]-N-(3-naphthalen-1-ylphenyl)-9,9-diphenylfluoren-4-amine
CID 174277156
2-[2-[9-(9,9-diphenylfluoren-1-yl)carbazol-2-yl]phenyl]-N,N-bis(4-phenylphenyl)aniline
CID 118337373
9-[4-(9,9-diphenylfluoren-4-yl)-2-phenylphenyl]-N-phenyl-N-(4-phenylphenyl)carbazol-2-amine
CID 171418861
N-[4-[3-[9-(9,9-diphenylfluoren-4-yl)carbazol-3-yl]phenyl]phenyl]-9,9-dimethyl-N-phenylfluoren-3-amine
CID 118462558
N,9,9-triphenyl-N-[2-[3-[9-(3-phenylphenyl)carbazol-2-yl]phenyl]phenyl]fluoren-3-amine
CID 118505787

Frequently Asked Questions

What is the IUPAC name of 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline?
The IUPAC name of 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline (CID 118265642) is 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline.
What is the SMILES notation for 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline?
The canonical SMILES for 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline is c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4-c4ccc(-c5ccc6c7ccccc7n(-c7cccc8c7-c7ccccc7C8(c7ccccc7)c7ccccc7)c6c5)cc4)cc3)cc2)cc1.
What is the InChIKey of 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline?
The InChIKey is LOTXKMGICWXGOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H50N2/c1-5-20-51(21-6-1)52-36-38-53(39-37-52)54-44-47-61(48-45-54)74(60-26-11-4-12-27-60)68-33-17-14-28-62(68)56-42-40-55(41-43-56)57-46-49-64-63-29-15-18-34-69(63)75(71(64)50-57)70-35-19-32-67-72(70)65-30-13-16-31-66(65)73(67,58-22-7-2-8-23-58)59-24-9-3-10-25-59/h1-50H.
What are the key properties of 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline?
2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline has a molecular weight of 955.22 g/mol, XLogP of 19.28, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[9-(9,9-diphenylfluoren-4-yl)carbazol-2-yl]phenyl]-N-phenyl-N-[4-(4-phenylphenyl)phenyl]aniline is sourced from PubChem (CID 118265642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).