N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine

C284H215N15 — CID 159710286

IUPACN-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine
SMILESCC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(N(c2ccccc2)c2ccccc2)cc1C3(C)C.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc21.Cc1cccc(N(c2ccccc2)c2ccc(C(c3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)c3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)cc2)c1.c1ccc(N(c2ccccc2)c2ccc3c(c2)C2(c4cc(N(c5ccccc5)c5ccccc5)ccc4-3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc32)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C73H52N4.C58H49N3.C54H36N4.C51H38N2.C48H40N2/c1-9-25-53(26-10-1)74(54-27-11-2-12-28-54)61-41-45-65-66-46-42-62(75(55-29-13-3-14-30-55)56-31-15-4-16-32-56)50-70(66)73(69(65)49-61)71-51-63(76(57-33-17-5-18-34-57)58-35-19-6-20-36-58)43-47-67(71)68-48-44-64(52-72(68)73)77(59-37-21-7-22-38-59)60-39-23-8-24-40-60;1-43-16-13-25-55(40-43)59(49-19-7-4-8-20-49)52-34-28-46(29-35-52)58(47-30-36-53(37-31-47)60(50-21-9-5-10-22-50)56-26-14-17-44(2)41-56)48-32-38-54(39-33-48)61(51-23-11-6-12-24-51)57-27-15-18-45(3)42-57;1-7-19-49-43(13-1)44-14-2-8-20-50(44)56(49)40-31-25-37(26-32-40)55(38-27-33-41(34-28-38)57-51-21-9-3-15-45(51)46-16-4-10-22-52(46)57)39-29-35-42(36-30-39)58-53-23-11-5-17-47(53)48-18-6-12-24-54(48)58;1-51(2)47-19-11-9-17-43(47)44-31-30-42(34-48(44)51)52(40-26-21-36(22-27-40)35-13-5-3-6-14-35)41-28-23-37(24-29-41)38-25-32-50-46(33-38)45-18-10-12-20-49(45)53(50)39-15-7-4-8-16-39;1-47(2)43-29-37(49(33-17-9-5-10-18-33)34-19-11-6-12-20-34)25-27-39(43)41-32-46-42(31-45(41)47)40-28-26-38(30-44(40)48(46,3)4)50(35-21-13-7-14-22-35)36-23-15-8-16-24-36/h1-52H;4-42,58H,1-3H3;1-36H;3-34H,1-2H3;5-32H,1-4H3
InChIKeyMYTDFROWYIBUPE-UHFFFAOYSA-N
MW3837.95 g/mol
LogP77.69
Rot. Bonds42

About N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine

N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine (PubChem CID 159710286) has the molecular formula C284H215N15 and a molecular weight of 3837.95 g/mol. Its IUPAC name is N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine.

Molecular Properties

Compound NameN-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine
PubChem CID159710286
Molecular FormulaC284H215N15
Molecular Weight3837.95 g/mol
Exact Mass3834.73
IUPAC NameN-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine
SMILESCC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(N(c2ccccc2)c2ccccc2)cc1C3(C)C.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc21.Cc1cccc(N(c2ccccc2)c2ccc(C(c3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)c3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)cc2)c1.c1ccc(N(c2ccccc2)c2ccc3c(c2)C2(c4cc(N(c5ccccc5)c5ccccc5)ccc4-3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc32)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1
InChIInChI=1S/C73H52N4.C58H49N3.C54H36N4.C51H38N2.C48H40N2/c1-9-25-53(26-10-1)74(54-27-11-2-12-28-54)61-41-45-65-66-46-42-62(75(55-29-13-3-14-30-55)56-31-15-4-16-32-56)50-70(66)73(69(65)49-61)71-51-63(76(57-33-17-5-18-34-57)58-35-19-6-20-36-58)43-47-67(71)68-48-44-64(52-72(68)73)77(59-37-21-7-22-38-59)60-39-23-8-24-40-60;1-43-16-13-25-55(40-43)59(49-19-7-4-8-20-49)52-34-28-46(29-35-52)58(47-30-36-53(37-31-47)60(50-21-9-5-10-22-50)56-26-14-17-44(2)41-56)48-32-38-54(39-33-48)61(51-23-11-6-12-24-51)57-27-15-18-45(3)42-57;1-7-19-49-43(13-1)44-14-2-8-20-50(44)56(49)40-31-25-37(26-32-40)55(38-27-33-41(34-28-38)57-51-21-9-3-15-45(51)46-16-4-10-22-52(46)57)39-29-35-42(36-30-39)58-53-23-11-5-17-47(53)48-18-6-12-24-54(48)58;1-51(2)47-19-11-9-17-43(47)44-31-30-42(34-48(44)51)52(40-26-21-36(22-27-40)35-13-5-3-6-14-35)41-28-23-37(24-29-41)38-25-32-50-46(33-38)45-18-10-12-20-49(45)53(50)39-15-7-4-8-16-39;1-47(2)43-29-37(49(33-17-9-5-10-18-33)34-19-11-6-12-20-34)25-27-39(43)41-32-46-42(31-45(41)47)40-28-26-38(30-44(40)48(46,3)4)50(35-21-13-7-14-22-35)36-23-15-8-16-24-36/h1-52H;4-42,58H,1-3H3;1-36H;3-34H,1-2H3;5-32H,1-4H3
InChIKeyMYTDFROWYIBUPE-UHFFFAOYSA-N
XLogP77.69
TPSA55.36 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds42
Heavy Atoms299
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003837.95
LogP ≤ 577.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine?
The IUPAC name of N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine (CID 159710286) is N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine.
What is the SMILES notation for N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine?
The canonical SMILES for N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine is CC1(C)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(N(c2ccccc2)c2ccccc2)cc1C3(C)C.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc21.Cc1cccc(N(c2ccccc2)c2ccc(C(c3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)c3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)cc2)c1.c1ccc(N(c2ccccc2)c2ccc3c(c2)C2(c4cc(N(c5ccccc5)c5ccccc5)ccc4-3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc32)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1.
What is the InChIKey of N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine?
The InChIKey is MYTDFROWYIBUPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H52N4.C58H49N3.C54H36N4.C51H38N2.C48H40N2/c1-9-25-53(26-10-1)74(54-27-11-2-12-28-54)61-41-45-65-66-46-42-62(75(55-29-13-3-14-30-55)56-31-15-4-16-32-56)50-70(66)73(69(65)49-61)71-51-63(76(57-33-17-5-18-34-57)58-35-19-6-20-36-58)43-47-67(71)68-48-44-64(52-72(68)73)77(59-37-21-7-22-38-59)60-39-23-8-24-40-60;1-43-16-13-25-55(40-43)59(49-19-7-4-8-20-49)52-34-28-46(29-35-52)58(47-30-36-53(37-31-47)60(50-21-9-5-10-22-50)56-26-14-17-44(2)41-56)48-32-38-54(39-33-48)61(51-23-11-6-12-24-51)57-27-15-18-45(3)42-57;1-7-19-49-43(13-1)44-14-2-8-20-50(44)56(49)40-31-25-37(26-32-40)55(38-27-33-41(34-28-38)57-51-21-9-3-15-45(51)46-16-4-10-22-52(46)57)39-29-35-42(36-30-39)58-53-23-11-5-17-47(53)48-18-6-12-24-54(48)58;1-51(2)47-19-11-9-17-43(47)44-31-30-42(34-48(44)51)52(40-26-21-36(22-27-40)35-13-5-3-6-14-35)41-28-23-37(24-29-41)38-25-32-50-46(33-38)45-18-10-12-20-49(45)53(50)39-15-7-4-8-16-39;1-47(2)43-29-37(49(33-17-9-5-10-18-33)34-19-11-6-12-20-34)25-27-39(43)41-32-46-42(31-45(41)47)40-28-26-38(30-44(40)48(46,3)4)50(35-21-13-7-14-22-35)36-23-15-8-16-24-36/h1-52H;4-42,58H,1-3H3;1-36H;3-34H,1-2H3;5-32H,1-4H3.
What are the key properties of N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine?
N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine has a molecular weight of 3837.95 g/mol, XLogP of 77.69, 42 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[bis[4-(N-(3-methylphenyl)anilino)phenyl]methyl]phenyl]-3-methyl-N-phenylaniline;4-carbazol-9-yl-N,N-bis(4-carbazol-9-ylphenyl)aniline;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(4-phenylphenyl)fluoren-2-amine;2-N,2-N,2-N',2-N',7-N,7-N,7-N',7-N'-octakis-phenyl-9,9'-spirobi[fluorene]-2,2',7,7'-tetramine;6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetraphenylindeno[1,2-b]fluorene-2,8-diamine is sourced from PubChem (CID 159710286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).