C238H182N8 — CID 158211365
N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[6-(9-phenylcarbazol-3-yl)naphthalen-2-yl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]fluoren-2-amine (PubChem CID 158211365) has the molecular formula C238H182N8 and a molecular weight of 3154.13 g/mol. Its IUPAC name is N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[6-(9-phenylcarbazol-3-yl)naphthalen-2-yl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]fluoren-2-amine.
| Compound Name | N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[6-(9-phenylcarbazol-3-yl)naphthalen-2-yl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]fluoren-2-amine |
|---|---|
| PubChem CID | 158211365 |
| Molecular Formula | C238H182N8 |
| Molecular Weight | 3154.13 g/mol |
| Exact Mass | 3151.45 |
| IUPAC Name | N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[6-(9-phenylcarbazol-3-yl)naphthalen-2-yl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]fluoren-2-amine;N-(9,9-dimethylfluoren-2-yl)-9,9-dimethyl-N-[4-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]phenyl]fluoren-2-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)cc5)cc4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc4c3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccccc3-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc21 |
| InChI | InChI=1S/C66H50N2.C60H46N2.C58H44N2.C54H42N2/c1-65(2)59-19-11-8-16-53(59)55-37-35-51(41-61(55)65)67(52-36-38-56-54-17-9-12-20-60(54)66(3,4)62(56)42-52)50-33-30-46(31-34-50)45-24-22-43(23-25-45)44-26-28-47(29-27-44)48-32-39-64-58(40-48)57-18-10-13-21-63(57)68(64)49-14-6-5-7-15-49;1-59(2)53-19-11-8-16-47(53)49-33-31-45(37-55(49)59)61(46-32-34-50-48-17-9-12-20-54(48)60(3,4)56(50)38-46)44-29-26-40(27-30-44)39-22-24-41(25-23-39)42-28-35-58-52(36-42)51-18-10-13-21-57(51)62(58)43-14-6-5-7-15-43;1-57(2)51-19-11-8-16-45(51)47-29-27-43(35-53(47)57)59(44-28-30-48-46-17-9-12-20-52(46)58(3,4)54(48)36-44)42-26-24-38-32-37(22-23-39(38)33-42)40-25-31-56-50(34-40)49-18-10-13-21-55(49)60(56)41-14-6-5-7-15-41;1-53(2)46-22-12-8-19-40(46)42-29-27-37(33-48(42)53)55(38-28-30-43-41-20-9-13-23-47(41)54(3,4)49(43)34-38)50-24-14-10-18-39(50)35-26-31-52-45(32-35)44-21-11-15-25-51(44)56(52)36-16-6-5-7-17-36/h5-42H,1-4H3;5-38H,1-4H3;5-36H,1-4H3;5-34H,1-4H3 |
| InChIKey | GCCQTIWBMHBISN-UHFFFAOYSA-N |
| XLogP | 64.29 |
| TPSA | 32.68 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 246 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3154.13 |
| LogP ≤ 5 | 64.29 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 8 |