N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine

C226H152N4O2S2 — CID 159645825

IUPACN-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4cccc5c4oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4cccc5c4sc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4cccc(-c5cccc6c5oc5ccccc56)c4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3)cc2)cc1.c1ccc(-c2cccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccccc3-c3cccc4c3sc3ccccc34)c2)cc1
InChIInChI=1S/C61H41NO.C55H37NO.2C55H37NS/c1-4-16-42(17-5-1)43-30-32-44(33-31-43)45-34-36-49(37-35-45)62(50-23-14-18-46(40-50)52-26-15-27-56-55-25-11-13-29-59(55)63-60(52)56)51-38-39-54-53-24-10-12-28-57(53)61(58(54)41-51,47-19-6-2-7-20-47)48-21-8-3-9-22-48;1-4-15-38(16-5-1)39-27-29-40(30-28-39)41-31-33-44(34-32-41)56(52-25-14-23-49-48-22-11-13-26-53(48)57-54(49)52)45-35-36-47-46-21-10-12-24-50(46)55(51(47)37-45,42-17-6-2-7-18-42)43-19-8-3-9-20-43;1-4-18-38(19-5-1)39-20-16-25-42(36-39)56(52-32-14-11-27-46(52)48-29-17-30-49-47-28-12-15-33-53(47)57-54(48)49)43-34-35-45-44-26-10-13-31-50(44)55(51(45)37-43,40-21-6-2-7-22-40)41-23-8-3-9-24-41;1-4-15-38(16-5-1)39-27-29-40(30-28-39)41-31-33-44(34-32-41)56(52-25-14-23-49-48-22-11-13-26-53(48)57-54(49)52)45-35-36-47-46-21-10-12-24-50(46)55(51(47)37-45,42-17-6-2-7-18-42)43-19-8-3-9-20-43/h1-41H;3*1-37H
InChIKeyMQYFCMCAGMXJMT-UHFFFAOYSA-N
MW3019.86 g/mol
LogP61.62
Rot. Bonds29

About N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine

N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine (PubChem CID 159645825) has the molecular formula C226H152N4O2S2 and a molecular weight of 3019.86 g/mol. Its IUPAC name is N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine.

Molecular Properties

Compound NameN-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine
PubChem CID159645825
Molecular FormulaC226H152N4O2S2
Molecular Weight3019.86 g/mol
Exact Mass3017.14
IUPAC NameN-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4cccc5c4oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4cccc5c4sc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4cccc(-c5cccc6c5oc5ccccc56)c4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3)cc2)cc1.c1ccc(-c2cccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccccc3-c3cccc4c3sc3ccccc34)c2)cc1
InChIInChI=1S/C61H41NO.C55H37NO.2C55H37NS/c1-4-16-42(17-5-1)43-30-32-44(33-31-43)45-34-36-49(37-35-45)62(50-23-14-18-46(40-50)52-26-15-27-56-55-25-11-13-29-59(55)63-60(52)56)51-38-39-54-53-24-10-12-28-57(53)61(58(54)41-51,47-19-6-2-7-20-47)48-21-8-3-9-22-48;1-4-15-38(16-5-1)39-27-29-40(30-28-39)41-31-33-44(34-32-41)56(52-25-14-23-49-48-22-11-13-26-53(48)57-54(49)52)45-35-36-47-46-21-10-12-24-50(46)55(51(47)37-45,42-17-6-2-7-18-42)43-19-8-3-9-20-43;1-4-18-38(19-5-1)39-20-16-25-42(36-39)56(52-32-14-11-27-46(52)48-29-17-30-49-47-28-12-15-33-53(47)57-54(48)49)43-34-35-45-44-26-10-13-31-50(44)55(51(45)37-43,40-21-6-2-7-22-40)41-23-8-3-9-24-41;1-4-15-38(16-5-1)39-27-29-40(30-28-39)41-31-33-44(34-32-41)56(52-25-14-23-49-48-22-11-13-26-53(48)57-54(49)52)45-35-36-47-46-21-10-12-24-50(46)55(51(47)37-45,42-17-6-2-7-18-42)43-19-8-3-9-20-43/h1-41H;3*1-37H
InChIKeyMQYFCMCAGMXJMT-UHFFFAOYSA-N
XLogP61.62
TPSA39.24 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds29
Heavy Atoms234
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003019.86
LogP ≤ 561.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine?
The IUPAC name of N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine (CID 159645825) is N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine.
What is the SMILES notation for N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine?
The canonical SMILES for N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4cccc5c4oc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4cccc5c4sc4ccccc45)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4cccc(-c5cccc6c5oc5ccccc56)c4)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3)cc2)cc1.c1ccc(-c2cccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccccc3-c3cccc4c3sc3ccccc34)c2)cc1.
What is the InChIKey of N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine?
The InChIKey is MQYFCMCAGMXJMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H41NO.C55H37NO.2C55H37NS/c1-4-16-42(17-5-1)43-30-32-44(33-31-43)45-34-36-49(37-35-45)62(50-23-14-18-46(40-50)52-26-15-27-56-55-25-11-13-29-59(55)63-60(52)56)51-38-39-54-53-24-10-12-28-57(53)61(58(54)41-51,47-19-6-2-7-20-47)48-21-8-3-9-22-48;1-4-15-38(16-5-1)39-27-29-40(30-28-39)41-31-33-44(34-32-41)56(52-25-14-23-49-48-22-11-13-26-53(48)57-54(49)52)45-35-36-47-46-21-10-12-24-50(46)55(51(47)37-45,42-17-6-2-7-18-42)43-19-8-3-9-20-43;1-4-18-38(19-5-1)39-20-16-25-42(36-39)56(52-32-14-11-27-46(52)48-29-17-30-49-47-28-12-15-33-53(47)57-54(48)49)43-34-35-45-44-26-10-13-31-50(44)55(51(45)37-43,40-21-6-2-7-22-40)41-23-8-3-9-24-41;1-4-15-38(16-5-1)39-27-29-40(30-28-39)41-31-33-44(34-32-41)56(52-25-14-23-49-48-22-11-13-26-53(48)57-54(49)52)45-35-36-47-46-21-10-12-24-50(46)55(51(47)37-45,42-17-6-2-7-18-42)43-19-8-3-9-20-43/h1-41H;3*1-37H.
What are the key properties of N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine?
N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine has a molecular weight of 3019.86 g/mol, XLogP of 61.62, 29 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(2-dibenzothiophen-4-ylphenyl)-9,9-diphenyl-N-(3-phenylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-4-amine;N-(9,9-diphenylfluoren-2-yl)-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-4-amine is sourced from PubChem (CID 159645825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).