4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline

C150H111N3 — CID 162262327

IUPAC4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline
SMILESCN(c1ccccc1)c1ccc(C2c3ccc(-c4ccc(-c5ccccc5)cc4)cc3-c3cc(-c4ccc(-c5ccccc5)cc4)ccc32)cc1.CN(c1ccccc1)c1ccc(C2c3ccc(-c4cccc(-c5ccccc5)c4)cc3-c3cc(-c4cccc(-c5ccccc5)c4)ccc32)cc1.CN(c1ccccc1)c1ccc(C2c3ccc(-c4ccccc4-c4ccccc4)cc3-c3cc(-c4ccccc4-c4ccccc4)ccc32)cc1
InChIInChI=1S/3C50H37N/c1-51(40-19-9-4-10-20-40)41-29-25-37(26-30-41)50-46-31-27-38(44-23-13-11-21-42(44)35-15-5-2-6-16-35)33-48(46)49-34-39(28-32-47(49)50)45-24-14-12-22-43(45)36-17-7-3-8-18-36;1-51(44-21-9-4-10-22-44)45-27-23-37(24-28-45)50-46-29-25-42(40-19-11-17-38(31-40)35-13-5-2-6-14-35)33-48(46)49-34-43(26-30-47(49)50)41-20-12-18-39(32-41)36-15-7-3-8-16-36;1-51(44-15-9-4-10-16-44)45-29-25-41(26-30-45)50-46-31-27-42(39-21-17-37(18-22-39)35-11-5-2-6-12-35)33-48(46)49-34-43(28-32-47(49)50)40-23-19-38(20-24-40)36-13-7-3-8-14-36/h3*2-34,50H,1H3
InChIKeyZZKOSIYEXTZUGT-UHFFFAOYSA-N
MW1955.56 g/mol
LogP39.85
Rot. Bonds21

About 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline

4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline (PubChem CID 162262327) has the molecular formula C150H111N3 and a molecular weight of 1955.56 g/mol. Its IUPAC name is 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline.

Molecular Properties

Compound Name4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline
PubChem CID162262327
Molecular FormulaC150H111N3
Molecular Weight1955.56 g/mol
Exact Mass1953.88
IUPAC Name4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline
SMILESCN(c1ccccc1)c1ccc(C2c3ccc(-c4ccc(-c5ccccc5)cc4)cc3-c3cc(-c4ccc(-c5ccccc5)cc4)ccc32)cc1.CN(c1ccccc1)c1ccc(C2c3ccc(-c4cccc(-c5ccccc5)c4)cc3-c3cc(-c4cccc(-c5ccccc5)c4)ccc32)cc1.CN(c1ccccc1)c1ccc(C2c3ccc(-c4ccccc4-c4ccccc4)cc3-c3cc(-c4ccccc4-c4ccccc4)ccc32)cc1
InChIInChI=1S/3C50H37N/c1-51(40-19-9-4-10-20-40)41-29-25-37(26-30-41)50-46-31-27-38(44-23-13-11-21-42(44)35-15-5-2-6-16-35)33-48(46)49-34-39(28-32-47(49)50)45-24-14-12-22-43(45)36-17-7-3-8-18-36;1-51(44-21-9-4-10-22-44)45-27-23-37(24-28-45)50-46-29-25-42(40-19-11-17-38(31-40)35-13-5-2-6-14-35)33-48(46)49-34-43(26-30-47(49)50)41-20-12-18-39(32-41)36-15-7-3-8-16-36;1-51(44-15-9-4-10-16-44)45-29-25-41(26-30-45)50-46-31-27-42(39-21-17-37(18-22-39)35-11-5-2-6-12-35)33-48(46)49-34-43(28-32-47(49)50)40-23-19-38(20-24-40)36-13-7-3-8-14-36/h3*2-34,50H,1H3
InChIKeyZZKOSIYEXTZUGT-UHFFFAOYSA-N
XLogP39.85
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds21
Heavy Atoms153
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001955.56
LogP ≤ 539.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline with MolForge

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Related Compounds

N-methyl-N-phenyl-3-(3-phenylphenyl)aniline;N-methyl-N-phenyl-3-(4-phenylphenyl)aniline;N-methyl-N-phenyl-4-(2-phenylphenyl)aniline;N-methyl-N-phenyl-4-(3-phenylphenyl)aniline
CID 158130832
9-[4-[4-[4-(9H-fluoren-9-yl)phenyl]-2-phenylphenyl]phenyl]-9H-fluorene
CID 58556035
9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene
CID 58556073
N-methyl-N,9-diphenyl-6-(2-phenylphenyl)carbazol-3-amine;N-methyl-N,9-diphenyl-6-(3-phenylphenyl)carbazol-3-amine;N-methyl-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine
CID 160593768
4-[3,6-bis(9,9-dimethylfluoren-2-yl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(9,9-diphenylfluoren-2-yl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(9,9'-spirobi[fluorene]-2-yl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline
CID 158185376
N-methyl-4-[3-(4-methylphenyl)phenyl]-N-phenylaniline
CID 58151391
N,4-diphenyl-N-[4-[4-(6,8,9-triphenyl-9H-fluoren-3-yl)phenyl]phenyl]aniline
CID 129256095
N-methyl-N-(4-naphthalen-1-ylphenyl)-4-(3-phenylphenyl)aniline
CID 70877185
N-methyl-N-phenylaniline;N-methyl-4-phenyl-N-(4-phenylphenyl)aniline
CID 157333767
3-phenyl-N-[4-(2-phenylphenyl)phenyl]-N-[4-(4-phenylphenyl)phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-[2-(3-phenylphenyl)phenyl]phenyl]aniline;3-phenyl-N-(4-phenylphenyl)-N-[4-[2-(4-phenylphenyl)phenyl]phenyl]aniline
CID 161496261
N-[4-[2-[3-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]-4-phenyl-N-(4-phenylphenyl)aniline
CID 146665574
9-[4-[4-[4-(9H-fluoren-9-yl)-2-phenylphenyl]phenyl]phenyl]-9H-fluorene
CID 58556038

Frequently Asked Questions

What is the IUPAC name of 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline?
The IUPAC name of 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline (CID 162262327) is 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline.
What is the SMILES notation for 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline?
The canonical SMILES for 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline is CN(c1ccccc1)c1ccc(C2c3ccc(-c4ccc(-c5ccccc5)cc4)cc3-c3cc(-c4ccc(-c5ccccc5)cc4)ccc32)cc1.CN(c1ccccc1)c1ccc(C2c3ccc(-c4cccc(-c5ccccc5)c4)cc3-c3cc(-c4cccc(-c5ccccc5)c4)ccc32)cc1.CN(c1ccccc1)c1ccc(C2c3ccc(-c4ccccc4-c4ccccc4)cc3-c3cc(-c4ccccc4-c4ccccc4)ccc32)cc1.
What is the InChIKey of 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline?
The InChIKey is ZZKOSIYEXTZUGT-UHFFFAOYSA-N. The full InChI is InChI=1S/3C50H37N/c1-51(40-19-9-4-10-20-40)41-29-25-37(26-30-41)50-46-31-27-38(44-23-13-11-21-42(44)35-15-5-2-6-16-35)33-48(46)49-34-39(28-32-47(49)50)45-24-14-12-22-43(45)36-17-7-3-8-18-36;1-51(44-21-9-4-10-22-44)45-27-23-37(24-28-45)50-46-29-25-42(40-19-11-17-38(31-40)35-13-5-2-6-14-35)33-48(46)49-34-43(26-30-47(49)50)41-20-12-18-39(32-41)36-15-7-3-8-16-36;1-51(44-15-9-4-10-16-44)45-29-25-41(26-30-45)50-46-31-27-42(39-21-17-37(18-22-39)35-11-5-2-6-12-35)33-48(46)49-34-43(28-32-47(49)50)40-23-19-38(20-24-40)36-13-7-3-8-14-36/h3*2-34,50H,1H3.
What are the key properties of 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline?
4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline has a molecular weight of 1955.56 g/mol, XLogP of 39.85, 21 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3,6-bis(2-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(3-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline;4-[3,6-bis(4-phenylphenyl)-9H-fluoren-9-yl]-N-methyl-N-phenylaniline is sourced from PubChem (CID 162262327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).