C203H149N3 — CID 159624987
N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine (PubChem CID 159624987) has the molecular formula C203H149N3 and a molecular weight of 2630.45 g/mol. Its IUPAC name is N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine.
| Compound Name | N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine |
|---|---|
| PubChem CID | 159624987 |
| Molecular Formula | C203H149N3 |
| Molecular Weight | 2630.45 g/mol |
| Exact Mass | 2628.18 |
| IUPAC Name | N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine;N-[3-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-diphenylfluoren-2-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cccc(N(c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)c3)cc21 |
| InChI | InChI=1S/2C71H51N.C61H47N/c1-69(2)63-35-18-15-32-57(63)60-41-38-49(45-66(60)69)48-22-21-31-54(44-48)72(55-39-42-61-58-33-16-19-36-64(58)70(67(61)46-55,50-23-7-3-8-24-50)51-25-9-4-10-26-51)56-40-43-62-59-34-17-20-37-65(59)71(68(62)47-56,52-27-11-5-12-28-52)53-29-13-6-14-30-53;1-69(2)63-32-18-15-29-57(63)60-42-37-49(45-66(60)69)48-35-38-54(39-36-48)72(55-40-43-61-58-30-16-19-33-64(58)70(67(61)46-55,50-21-7-3-8-22-50)51-23-9-4-10-24-51)56-41-44-62-59-31-17-20-34-65(59)71(68(62)47-56,52-25-11-5-12-26-52)53-27-13-6-14-28-53;1-59(2)53-27-14-11-24-47(53)50-33-30-41(37-56(50)59)40-18-17-23-44(36-40)62(45-31-34-51-48-25-12-15-28-54(48)60(3,4)57(51)38-45)46-32-35-52-49-26-13-16-29-55(49)61(58(52)39-46,42-19-7-5-8-20-42)43-21-9-6-10-22-43/h2*3-47H,1-2H3;5-39H,1-4H3 |
| InChIKey | MOJJKPKGVZVEEE-UHFFFAOYSA-N |
| XLogP | 51.51 |
| TPSA | 9.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 22 |
| Heavy Atoms | 206 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2630.45 |
| LogP ≤ 5 | 51.51 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |