N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine

C273H236N4 — CID 158818706

IUPACN-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine
SMILESCC(C)(c1ccccc1)c1ccc(N(c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2-4)c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2-4)cc1.CC1(C)c2ccccc2-c2cc3c(cc21)-c1cc2c(cc1C3(C)C)-c1ccc(N(c3ccc4c(c3)C(C)(C)c3cc5c(cc3-4)C(C)(C)c3cc4c(cc3-5)C(C)(C)c3ccccc3-4)c3cccc4ccccc34)cc1C2(C)C.CC1(C)c2ccccc2-c2cc3c(cc21)-c1cc2c(cc1C3(C)C)-c1ccc(Nc3ccc4c(c3)C(C)(C)c3cc5c(cc3-4)C(C)(C)c3cc4c(cc3-5)C(C)(C)c3ccccc3-4)cc1C2(C)C.CC1(C)c2ccccc2-c2cc3c(cc21)-c1ccc(N(c2ccc4c(c2)C(C)(C)c2cc5c(cc2-4)C(C)(C)c2ccccc2-5)c2c4ccccc4c(-c4ccccc4)c4ccccc24)cc1C3(C)C
InChIInChI=1S/C76H65N.C68H55N.C66H59N.C63H57N/c1-71(2)58-25-17-15-23-46(58)50-34-66-54(38-62(50)71)56-40-64-52(36-68(56)75(66,9)10)48-30-28-43(32-60(48)73(64,5)6)77(70-27-19-21-42-20-13-14-22-45(42)70)44-29-31-49-53-37-69-57(41-65(53)74(7,8)61(49)33-44)55-39-63-51(35-67(55)76(69,11)12)47-24-16-18-26-59(47)72(63,3)4;1-65(2)55-28-18-16-22-43(55)51-36-61-53(38-59(51)65)45-32-30-41(34-57(45)67(61,5)6)69(64-49-26-14-12-24-47(49)63(40-20-10-9-11-21-40)48-25-13-15-27-50(48)64)42-31-33-46-54-39-60-52(37-62(54)68(7,8)58(46)35-42)44-23-17-19-29-56(44)66(60,3)4;1-61(2)49-19-15-13-17-37(49)41-27-57-45(31-53(41)61)47-33-55-43(29-59(47)65(57,9)10)39-23-21-35(25-51(39)63(55,5)6)67-36-22-24-40-44-30-60-48(34-56(44)64(7,8)52(40)26-36)46-32-54-42(28-58(46)66(60,11)12)38-18-14-16-20-50(38)62(54,3)4;1-59(2,38-18-12-11-13-19-38)39-24-26-40(27-25-39)64(41-28-30-45-49-36-55-47(34-57(49)62(7,8)53(45)32-41)43-20-14-16-22-51(43)60(55,3)4)42-29-31-46-50-37-56-48(35-58(50)63(9,10)54(46)33-42)44-21-15-17-23-52(44)61(56,5)6/h13-41H,1-12H3;9-39H,1-8H3;13-34,67H,1-12H3;11-37H,1-10H3
InChIKeyIVPBSMAHGVDGRC-UHFFFAOYSA-N
MW3572.92 g/mol
LogP72.48
Rot. Bonds14

About N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine

N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine (PubChem CID 158818706) has the molecular formula C273H236N4 and a molecular weight of 3572.92 g/mol. Its IUPAC name is N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine.

Molecular Properties

Compound NameN-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine
PubChem CID158818706
Molecular FormulaC273H236N4
Molecular Weight3572.92 g/mol
Exact Mass3569.86
IUPAC NameN-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine
SMILESCC(C)(c1ccccc1)c1ccc(N(c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2-4)c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2-4)cc1.CC1(C)c2ccccc2-c2cc3c(cc21)-c1cc2c(cc1C3(C)C)-c1ccc(N(c3ccc4c(c3)C(C)(C)c3cc5c(cc3-4)C(C)(C)c3cc4c(cc3-5)C(C)(C)c3ccccc3-4)c3cccc4ccccc34)cc1C2(C)C.CC1(C)c2ccccc2-c2cc3c(cc21)-c1cc2c(cc1C3(C)C)-c1ccc(Nc3ccc4c(c3)C(C)(C)c3cc5c(cc3-4)C(C)(C)c3cc4c(cc3-5)C(C)(C)c3ccccc3-4)cc1C2(C)C.CC1(C)c2ccccc2-c2cc3c(cc21)-c1ccc(N(c2ccc4c(c2)C(C)(C)c2cc5c(cc2-4)C(C)(C)c2ccccc2-5)c2c4ccccc4c(-c4ccccc4)c4ccccc24)cc1C3(C)C
InChIInChI=1S/C76H65N.C68H55N.C66H59N.C63H57N/c1-71(2)58-25-17-15-23-46(58)50-34-66-54(38-62(50)71)56-40-64-52(36-68(56)75(66,9)10)48-30-28-43(32-60(48)73(64,5)6)77(70-27-19-21-42-20-13-14-22-45(42)70)44-29-31-49-53-37-69-57(41-65(53)74(7,8)61(49)33-44)55-39-63-51(35-67(55)76(69,11)12)47-24-16-18-26-59(47)72(63,3)4;1-65(2)55-28-18-16-22-43(55)51-36-61-53(38-59(51)65)45-32-30-41(34-57(45)67(61,5)6)69(64-49-26-14-12-24-47(49)63(40-20-10-9-11-21-40)48-25-13-15-27-50(48)64)42-31-33-46-54-39-60-52(37-62(54)68(7,8)58(46)35-42)44-23-17-19-29-56(44)66(60,3)4;1-61(2)49-19-15-13-17-37(49)41-27-57-45(31-53(41)61)47-33-55-43(29-59(47)65(57,9)10)39-23-21-35(25-51(39)63(55,5)6)67-36-22-24-40-44-30-60-48(34-56(44)64(7,8)52(40)26-36)46-32-54-42(28-58(46)66(60,11)12)38-18-14-16-20-50(38)62(54,3)4;1-59(2,38-18-12-11-13-19-38)39-24-26-40(27-25-39)64(41-28-30-45-49-36-55-47(34-57(49)62(7,8)53(45)32-41)43-20-14-16-22-51(43)60(55,3)4)42-29-31-46-50-37-56-48(35-58(50)63(9,10)54(46)33-42)44-21-15-17-23-52(44)61(56,5)6/h13-41H,1-12H3;9-39H,1-8H3;13-34,67H,1-12H3;11-37H,1-10H3
InChIKeyIVPBSMAHGVDGRC-UHFFFAOYSA-N
XLogP72.48
TPSA21.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms277
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003572.92
LogP ≤ 572.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine with MolForge

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Related Compounds

10-[4-[(9,9-dimethylfluoren-2-yl)-naphthalen-1-ylamino]phenyl]-N-(4-methylphenyl)-N-naphthalen-1-ylanthracen-9-amine
CID 59221647
1-N-(9,9-dimethylfluoren-2-yl)-4-N-naphthalen-1-yl-4-N-[4-[N-naphthalen-1-yl-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-1-N-phenylbenzene-1,4-diamine
CID 59025130
6,6,12,12-tetramethyl-2-N,2-N,8-N,8-N-tetrakis[4-(N-naphthalen-1-ylanilino)phenyl]indeno[1,2-b]fluorene-2,8-diamine
CID 59801002
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-naphthalen-1-ylfluoren-2-amine
CID 58983323
9,9-dimethyl-N-phenyl-N-[2,3,5,6-tetrafluoro-4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]fluoren-2-amine
CID 59221652
9,9-dimethyl-N-[4-[4-[4-(N-naphthalen-1-ylanilino)phenyl]-2,5-diphenylphenyl]phenyl]-N-phenylfluoren-2-amine
CID 176611486
9,9-dimethyl-N-[4-[4-[N-naphthalen-1-yl-4-(3-phenylphenyl)anilino]phenyl]phenyl]-N-(4-phenylphenyl)fluoren-2-amine;N-[4-[4-(N-(4-phenylphenyl)anilino)phenyl]phenyl]-N-[4-(3-phenylphenyl)phenyl]naphthalen-1-amine;N-[4-(3-phenylphenyl)phenyl]-N-[4-[4-[4-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]anilino]phenyl]phenyl]naphthalen-1-amine
CID 158708214
N,N-bis(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;1-N,1-N-diphenyl-4-N,4-N-bis[4-(N-phenylanilino)phenyl]benzene-1,4-diamine;4-N-naphthalen-1-yl-1-N,1-N-bis[4-(N-naphthalen-1-ylanilino)phenyl]-4-N-phenylbenzene-1,4-diamine;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
CID 159694712
N-[3-[2-[4-[2-[3-(N-(9,9-dimethylfluoren-2-yl)anilino)phenyl]propan-2-yl]phenyl]propan-2-yl]phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 143493158
2-N-(9,9-dimethylfluoren-2-yl)-7-N-[7-(N-(9,9-dimethylfluoren-2-yl)anilino)phenanthren-2-yl]-2-N,7-N-diphenylphenanthrene-2,7-diamine;2-N,7-N-dinaphthalen-1-yl-2-N-[7-(N-naphthalen-1-ylanilino)phenanthren-2-yl]-7-N-phenylphenanthrene-2,7-diamine;2-N-naphthalen-1-yl-7-N-[7-(N-naphthalen-1-ylanilino)phenanthren-2-yl]-2-N-phenyl-7-N-(4-phenylphenyl)phenanthrene-2,7-diamine
CID 158290526
9,9-dimethyl-N-phenyl-N-[4-[2-[4-(N-phenylanilino)phenyl]propan-2-yl]phenyl]fluoren-2-amine
CID 168810581
9,9-dimethyl-N-phenyl-N-[2,3,5,6-tetrafluoro-4-[4-(N-naphthalen-1-yl-4-phenylanilino)phenyl]phenyl]fluoren-2-amine
CID 59221527

Frequently Asked Questions

What is the IUPAC name of N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine?
The IUPAC name of N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine (CID 158818706) is N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine.
What is the SMILES notation for N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine?
The canonical SMILES for N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine is CC(C)(c1ccccc1)c1ccc(N(c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2-4)c2ccc3c(c2)C(C)(C)c2cc4c(cc2-3)C(C)(C)c2ccccc2-4)cc1.CC1(C)c2ccccc2-c2cc3c(cc21)-c1cc2c(cc1C3(C)C)-c1ccc(N(c3ccc4c(c3)C(C)(C)c3cc5c(cc3-4)C(C)(C)c3cc4c(cc3-5)C(C)(C)c3ccccc3-4)c3cccc4ccccc34)cc1C2(C)C.CC1(C)c2ccccc2-c2cc3c(cc21)-c1cc2c(cc1C3(C)C)-c1ccc(Nc3ccc4c(c3)C(C)(C)c3cc5c(cc3-4)C(C)(C)c3cc4c(cc3-5)C(C)(C)c3ccccc3-4)cc1C2(C)C.CC1(C)c2ccccc2-c2cc3c(cc21)-c1ccc(N(c2ccc4c(c2)C(C)(C)c2cc5c(cc2-4)C(C)(C)c2ccccc2-5)c2c4ccccc4c(-c4ccccc4)c4ccccc24)cc1C3(C)C.
What is the InChIKey of N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine?
The InChIKey is IVPBSMAHGVDGRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C76H65N.C68H55N.C66H59N.C63H57N/c1-71(2)58-25-17-15-23-46(58)50-34-66-54(38-62(50)71)56-40-64-52(36-68(56)75(66,9)10)48-30-28-43(32-60(48)73(64,5)6)77(70-27-19-21-42-20-13-14-22-45(42)70)44-29-31-49-53-37-69-57(41-65(53)74(7,8)61(49)33-44)55-39-63-51(35-67(55)76(69,11)12)47-24-16-18-26-59(47)72(63,3)4;1-65(2)55-28-18-16-22-43(55)51-36-61-53(38-59(51)65)45-32-30-41(34-57(45)67(61,5)6)69(64-49-26-14-12-24-47(49)63(40-20-10-9-11-21-40)48-25-13-15-27-50(48)64)42-31-33-46-54-39-60-52(37-62(54)68(7,8)58(46)35-42)44-23-17-19-29-56(44)66(60,3)4;1-61(2)49-19-15-13-17-37(49)41-27-57-45(31-53(41)61)47-33-55-43(29-59(47)65(57,9)10)39-23-21-35(25-51(39)63(55,5)6)67-36-22-24-40-44-30-60-48(34-56(44)64(7,8)52(40)26-36)46-32-54-42(28-58(46)66(60,11)12)38-18-14-16-20-50(38)62(54,3)4;1-59(2,38-18-12-11-13-19-38)39-24-26-40(27-25-39)64(41-28-30-45-49-36-55-47(34-57(49)62(7,8)53(45)32-41)43-20-14-16-22-51(43)60(55,3)4)42-29-31-46-50-37-56-48(35-58(50)63(9,10)54(46)33-42)44-21-15-17-23-52(44)61(56,5)6/h13-41H,1-12H3;9-39H,1-8H3;13-34,67H,1-12H3;11-37H,1-10H3.
What are the key properties of N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine?
N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine has a molecular weight of 3572.92 g/mol, XLogP of 72.48, 14 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;N-(5,5,15,15,25,25-hexamethyl-8-heptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaenyl)-5,5,15,15,25,25-hexamethyl-N-naphthalen-1-ylheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19,21,23,26-dodecaen-8-amine;6,6,12,12-tetramethyl-N-(10-phenylanthracen-9-yl)-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine;6,6,12,12-tetramethyl-N-[4-(2-phenylpropan-2-yl)phenyl]-N-(6,6,12,12-tetramethylindeno[1,2-b]fluoren-2-yl)indeno[1,2-b]fluoren-2-amine is sourced from PubChem (CID 158818706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).