C174H135N3 — CID 158351928
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-phenyl-4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[2,5-dimethyl-4-(4-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-[2,5-dimethyl-4-(4-phenylphenyl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine (PubChem CID 158351928) has the molecular formula C174H135N3 and a molecular weight of 2268.01 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-phenyl-4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[2,5-dimethyl-4-(4-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-[2,5-dimethyl-4-(4-phenylphenyl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine.
| Compound Name | N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-phenyl-4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[2,5-dimethyl-4-(4-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-[2,5-dimethyl-4-(4-phenylphenyl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine |
|---|---|
| PubChem CID | 158351928 |
| Molecular Formula | C174H135N3 |
| Molecular Weight | 2268.01 g/mol |
| Exact Mass | 2266.07 |
| IUPAC Name | N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-phenyl-4-(4-phenylphenyl)phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-[2,5-dimethyl-4-(4-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-2-amine;N-[2,5-dimethyl-4-(4-phenylphenyl)phenyl]-N-(9,9-diphenylfluoren-2-yl)-9,9-dimethylfluoren-2-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc(-c4ccc(-c5ccccc5)cc4)cc3-c3ccccc3)cc21.Cc1cc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c(C)cc1-c1ccc(-c2ccccc2)cc1.Cc1cc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)c(C)cc1-c1ccc(-c2ccccc2)cc1 |
| InChI | InChI=1S/C60H45N.C60H47N.C54H43N/c1-38-35-58(39(2)34-51(38)42-28-26-41(27-29-42)40-16-6-5-7-17-40)61(43-30-32-49-45-18-8-12-22-52(45)59(3,4)56(49)36-43)44-31-33-50-48-21-11-15-25-55(48)60(57(50)37-44)53-23-13-9-19-46(53)47-20-10-14-24-54(47)60;1-40-37-58(41(2)36-53(40)44-30-28-43(29-31-44)42-18-8-5-9-19-42)61(47-32-34-51-49-24-14-16-26-54(49)59(3,4)56(51)38-47)48-33-35-52-50-25-15-17-27-55(50)60(57(52)39-48,45-20-10-6-11-21-45)46-22-12-7-13-23-46;1-53(2)48-21-13-11-19-43(48)45-30-28-41(34-50(45)53)55(42-29-31-46-44-20-12-14-22-49(44)54(3,4)51(46)35-42)52-32-27-40(33-47(52)39-17-9-6-10-18-39)38-25-23-37(24-26-38)36-15-7-5-8-16-36/h5-37H,1-4H3;5-39H,1-4H3;5-35H,1-4H3 |
| InChIKey | GSKRUFFQWACNAV-UHFFFAOYSA-N |
| XLogP | 46.30 |
| TPSA | 9.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 177 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2268.01 |
| LogP ≤ 5 | 46.30 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |