N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline

C256H172N4 — CID 165111097

IUPACN-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline
SMILES[2H]c1c([2H])c([2H])c(N(c2ccc(C3(c4ccccc4)c4ccccc4-c4cc5ccccc5cc43)cc2)c2ccc(C3(c4ccccc4)c4ccccc4-c4cc5ccccc5cc43)cc2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2ccc(C3(c4ccccc4)c4ccccc4-c4ccc5ccccc5c43)cc2)c2ccc(C3(c4ccccc4)c4ccccc4-c4ccc5ccccc5c43)cc2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2c-3ccc3ccccc23)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2c-3ccc3ccccc23)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccc4ccccc4c2-3)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccc4ccccc4c2-3)c([2H])c1[2H]
InChIInChI=1S/4C64H43N/c1-6-22-46(23-7-1)63(47-24-8-2-9-25-47)57-40-34-44-20-16-18-32-53(44)61(57)55-38-36-51(42-59(55)63)65(50-30-14-5-15-31-50)52-37-39-56-60(43-52)64(48-26-10-3-11-27-48,49-28-12-4-13-29-49)58-41-35-45-21-17-19-33-54(45)62(56)58;1-6-22-46(23-7-1)63(47-24-8-2-9-25-47)59-42-51(36-40-55(59)57-38-34-44-20-16-18-32-53(44)61(57)63)65(50-30-14-5-15-31-50)52-37-41-56-58-39-35-45-21-17-19-33-54(45)62(58)64(60(56)43-52,48-26-10-3-11-27-48)49-28-12-4-13-29-49;1-4-22-48(23-5-1)63(59-30-16-14-28-55(59)57-40-44-18-10-12-20-46(44)42-61(57)63)50-32-36-53(37-33-50)65(52-26-8-3-9-27-52)54-38-34-51(35-39-54)64(49-24-6-2-7-25-49)60-31-17-15-29-56(60)58-41-45-19-11-13-21-47(45)43-62(58)64;1-4-20-46(21-5-1)63(59-30-16-14-28-55(59)57-42-32-44-18-10-12-26-53(44)61(57)63)48-34-38-51(39-35-48)65(50-24-8-3-9-25-50)52-40-36-49(37-41-52)64(47-22-6-2-7-23-47)60-31-17-15-29-56(60)58-43-33-45-19-11-13-27-54(45)62(58)64/h4*1-43H/i2*5D,14D,15D,30D,31D;3D,8D,9D,26D,27D;3D,8D,9D,24D,25D
InChIKeyZYOWICMMBNODPF-UQYWEAHVSA-N
MW3324.34 g/mol
LogP64.76
Rot. Bonds28

About N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline

N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline (PubChem CID 165111097) has the molecular formula C256H172N4 and a molecular weight of 3324.34 g/mol. Its IUPAC name is N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline.

Molecular Properties

Compound NameN-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline
PubChem CID165111097
Molecular FormulaC256H172N4
Molecular Weight3324.34 g/mol
Exact Mass3321.48
IUPAC NameN-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline
SMILES[2H]c1c([2H])c([2H])c(N(c2ccc(C3(c4ccccc4)c4ccccc4-c4cc5ccccc5cc43)cc2)c2ccc(C3(c4ccccc4)c4ccccc4-c4cc5ccccc5cc43)cc2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2ccc(C3(c4ccccc4)c4ccccc4-c4ccc5ccccc5c43)cc2)c2ccc(C3(c4ccccc4)c4ccccc4-c4ccc5ccccc5c43)cc2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2c-3ccc3ccccc23)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2c-3ccc3ccccc23)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccc4ccccc4c2-3)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccc4ccccc4c2-3)c([2H])c1[2H]
InChIInChI=1S/4C64H43N/c1-6-22-46(23-7-1)63(47-24-8-2-9-25-47)57-40-34-44-20-16-18-32-53(44)61(57)55-38-36-51(42-59(55)63)65(50-30-14-5-15-31-50)52-37-39-56-60(43-52)64(48-26-10-3-11-27-48,49-28-12-4-13-29-49)58-41-35-45-21-17-19-33-54(45)62(56)58;1-6-22-46(23-7-1)63(47-24-8-2-9-25-47)59-42-51(36-40-55(59)57-38-34-44-20-16-18-32-53(44)61(57)63)65(50-30-14-5-15-31-50)52-37-41-56-58-39-35-45-21-17-19-33-54(45)62(58)64(60(56)43-52,48-26-10-3-11-27-48)49-28-12-4-13-29-49;1-4-22-48(23-5-1)63(59-30-16-14-28-55(59)57-40-44-18-10-12-20-46(44)42-61(57)63)50-32-36-53(37-33-50)65(52-26-8-3-9-27-52)54-38-34-51(35-39-54)64(49-24-6-2-7-25-49)60-31-17-15-29-56(60)58-41-45-19-11-13-21-47(45)43-62(58)64;1-4-20-46(21-5-1)63(59-30-16-14-28-55(59)57-42-32-44-18-10-12-26-53(44)61(57)63)48-34-38-51(39-35-48)65(50-24-8-3-9-25-50)52-40-36-49(37-41-52)64(47-22-6-2-7-23-47)60-31-17-15-29-56(60)58-43-33-45-19-11-13-27-54(45)62(58)64/h4*1-43H/i2*5D,14D,15D,30D,31D;3D,8D,9D,26D,27D;3D,8D,9D,24D,25D
InChIKeyZYOWICMMBNODPF-UQYWEAHVSA-N
XLogP64.76
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds28
Heavy Atoms260
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003324.34
LogP ≤ 564.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline with MolForge

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Related Compounds

7-N',7-N',17-N',17-N'-tetraphenylspiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-7',17'-diamine
CID 137495014
N-(4-phenylphenyl)-N-spiro[benzo[a]fluorene-11,9'-fluorene]-9-ylspiro[benzo[g]fluorene-7,9'-fluorene]-9-amine
CID 134194037
9,9-bis(2,3,4,5,6-pentadeuteriophenyl)-N,N-bis[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 164783664
N-(9,9-diphenylfluoren-2-yl)-N-phenylspiro[benzo[b]fluorene-11,9'-fluorene]-2-amine
CID 134193981
2-N-naphthalen-1-yl-2-N'-(2,3,4,5,6-pentadeuteriophenyl)-2-N,2-N'-diphenyl-9,9'-spirobi[fluorene]-2,2'-diamine
CID 168791654
N,N-bis(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-amine
CID 134193953
8-N,8-N,23-N,23-N,13,13,28,28-octakis-phenylheptacyclo[15.11.0.02,14.03,12.05,10.018,27.020,25]octacosa-1(17),2(14),3(12),4,6,8,10,15,18(27),19,21,23,25-tridecaene-8,23-diamine
CID 155361342
N-naphthalen-2-yl-N-(4-phenylphenyl)spiro[benzo[c]fluorene-7,9'-fluorene]-2'-amine
CID 134216072
N-(4-naphthalen-1-ylphenyl)-N-phenylspiro[benzo[g]fluorene-7,9'-fluorene]-9-amine
CID 134240776
N-naphthalen-2-yl-N-(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-amine
CID 134193952
3-(N-[7'-(N-(3-cyanophenyl)anilino)spiro[benzo[c]fluorene-7,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2(11),3,5,7,9,14(19),15,17,20-decaene]-17'-yl]anilino)benzonitrile
CID 137493930
N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-amine;N-(9,9-diphenylfluoren-2-yl)-N-(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-amine;N-(3-phenylphenyl)-N-(4-phenylphenyl)spiro[benzo[g]fluorene-7,9'-fluorene]-9-amine
CID 159953736

Frequently Asked Questions

What is the IUPAC name of N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline?
The IUPAC name of N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline (CID 165111097) is N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline.
What is the SMILES notation for N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline?
The canonical SMILES for N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline is [2H]c1c([2H])c([2H])c(N(c2ccc(C3(c4ccccc4)c4ccccc4-c4cc5ccccc5cc43)cc2)c2ccc(C3(c4ccccc4)c4ccccc4-c4cc5ccccc5cc43)cc2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2ccc(C3(c4ccccc4)c4ccccc4-c4ccc5ccccc5c43)cc2)c2ccc(C3(c4ccccc4)c4ccccc4-c4ccc5ccccc5c43)cc2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2c-3ccc3ccccc23)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2c-3ccc3ccccc23)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccc4ccccc4c2-3)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccc4ccccc4c2-3)c([2H])c1[2H].
What is the InChIKey of N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline?
The InChIKey is ZYOWICMMBNODPF-UQYWEAHVSA-N. The full InChI is InChI=1S/4C64H43N/c1-6-22-46(23-7-1)63(47-24-8-2-9-25-47)57-40-34-44-20-16-18-32-53(44)61(57)55-38-36-51(42-59(55)63)65(50-30-14-5-15-31-50)52-37-39-56-60(43-52)64(48-26-10-3-11-27-48,49-28-12-4-13-29-49)58-41-35-45-21-17-19-33-54(45)62(56)58;1-6-22-46(23-7-1)63(47-24-8-2-9-25-47)59-42-51(36-40-55(59)57-38-34-44-20-16-18-32-53(44)61(57)63)65(50-30-14-5-15-31-50)52-37-41-56-58-39-35-45-21-17-19-33-54(45)62(58)64(60(56)43-52,48-26-10-3-11-27-48)49-28-12-4-13-29-49;1-4-22-48(23-5-1)63(59-30-16-14-28-55(59)57-40-44-18-10-12-20-46(44)42-61(57)63)50-32-36-53(37-33-50)65(52-26-8-3-9-27-52)54-38-34-51(35-39-54)64(49-24-6-2-7-25-49)60-31-17-15-29-56(60)58-41-45-19-11-13-21-47(45)43-62(58)64;1-4-20-46(21-5-1)63(59-30-16-14-28-55(59)57-42-32-44-18-10-12-26-53(44)61(57)63)48-34-38-51(39-35-48)65(50-24-8-3-9-25-50)52-40-36-49(37-41-52)64(47-22-6-2-7-23-47)60-31-17-15-29-56(60)58-43-33-45-19-11-13-27-54(45)62(58)64/h4*1-43H/i2*5D,14D,15D,30D,31D;3D,8D,9D,26D,27D;3D,8D,9D,24D,25D.
What are the key properties of N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline?
N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline has a molecular weight of 3324.34 g/mol, XLogP of 64.76, 28 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(11,11-diphenylbenzo[a]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-11,11-diphenylbenzo[a]fluoren-9-amine;N-(7,7-diphenylbenzo[g]fluoren-9-yl)-N-(2,3,4,5,6-pentadeuteriophenyl)-7,7-diphenylbenzo[g]fluoren-9-amine;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[a]fluoren-11-yl)phenyl]aniline;2,3,4,5,6-pentadeuterio-N,N-bis[4-(11-phenylbenzo[b]fluoren-11-yl)phenyl]aniline is sourced from PubChem (CID 165111097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).