C207H153N3 — CID 158885450
N-[2-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-7,7-dimethylbenzo[g]fluoren-9-amine;N-(9,9-diphenylfluoren-2-yl)-11,11-dimethyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)benzo[b]fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[2-(9,9-diphenylfluoren-3-yl)phenyl]-7,7-dimethylbenzo[g]fluoren-8-amine (PubChem CID 158885450) has the molecular formula C207H153N3 and a molecular weight of 2682.52 g/mol. Its IUPAC name is N-[2-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-7,7-dimethylbenzo[g]fluoren-9-amine;N-(9,9-diphenylfluoren-2-yl)-11,11-dimethyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)benzo[b]fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[2-(9,9-diphenylfluoren-3-yl)phenyl]-7,7-dimethylbenzo[g]fluoren-8-amine.
| Compound Name | N-[2-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-7,7-dimethylbenzo[g]fluoren-9-amine;N-(9,9-diphenylfluoren-2-yl)-11,11-dimethyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)benzo[b]fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[2-(9,9-diphenylfluoren-3-yl)phenyl]-7,7-dimethylbenzo[g]fluoren-8-amine |
|---|---|
| PubChem CID | 158885450 |
| Molecular Formula | C207H153N3 |
| Molecular Weight | 2682.52 g/mol |
| Exact Mass | 2680.21 |
| IUPAC Name | N-[2-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-7,7-dimethylbenzo[g]fluoren-9-amine;N-(9,9-diphenylfluoren-2-yl)-11,11-dimethyl-N-(2-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)benzo[b]fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-N-[2-(9,9-diphenylfluoren-3-yl)phenyl]-7,7-dimethylbenzo[g]fluoren-8-amine |
| SMILES | CC1(C)c2cc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccccc3-c3ccc4c(c3)C3(CCCC3)c3ccccc3-4)ccc2-c2cc3ccccc3cc21.CC1(C)c2ccc3ccccc3c2-c2cccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccccc3-c3ccc4c(c3)-c3ccccc3C4(c3ccccc3)c3ccccc3)c21.CC1(C)c2ccccc2-c2ccc(-c3ccccc3N(c3ccc4c(c3)C(C)(C)c3ccc5ccccc5c3-4)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21 |
| InChI | InChI=1S/C75H53N.C67H51N.C65H49N/c1-73(2)67-47-42-50-24-15-16-34-58(50)71(67)62-37-23-41-70(72(62)73)76(56-44-45-61-59-35-17-20-38-64(59)75(68(61)49-56,54-29-11-5-12-30-54)55-31-13-6-14-32-55)69-40-22-19-33-57(69)51-43-46-66-63(48-51)60-36-18-21-39-65(60)74(66,52-25-7-3-8-26-52)53-27-9-4-10-28-53;1-65(2)60-40-45-20-10-9-19-44(45)39-57(60)56-36-33-49(42-61(56)65)68(64-30-16-13-25-51(64)46-31-34-54-52-26-11-14-28-58(52)66(62(54)41-46)37-17-18-38-66)50-32-35-55-53-27-12-15-29-59(53)67(63(55)43-50,47-21-5-3-6-22-47)48-23-7-4-8-24-48;1-63(2)55-28-16-13-26-50(55)52-35-31-43(39-58(52)63)48-24-15-18-30-61(48)66(46-34-37-54-59(40-46)64(3,4)57-38-32-42-19-11-12-25-49(42)62(54)57)47-33-36-53-51-27-14-17-29-56(51)65(60(53)41-47,44-20-7-5-8-21-44)45-22-9-6-10-23-45/h3-49H,1-2H3;3-16,19-36,39-43H,17-18,37-38H2,1-2H3;5-41H,1-4H3 |
| InChIKey | JDOMMRYAKBIFID-UHFFFAOYSA-N |
| XLogP | 53.45 |
| TPSA | 9.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 210 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2682.52 |
| LogP ≤ 5 | 53.45 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |