C178H158N6 — CID 165095817
7-cyclohexyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-amine;7-cyclohexyl-N-(7-cyclohexyl-9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-amine;7-cyclohexyl-N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)-9-phenylcarbazol-3-amine (PubChem CID 165095817) has the molecular formula C178H158N6 and a molecular weight of 2381.26 g/mol. Its IUPAC name is 7-cyclohexyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-amine;7-cyclohexyl-N-(7-cyclohexyl-9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-amine;7-cyclohexyl-N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)-9-phenylcarbazol-3-amine.
| Compound Name | 7-cyclohexyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-amine;7-cyclohexyl-N-(7-cyclohexyl-9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-amine;7-cyclohexyl-N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)-9-phenylcarbazol-3-amine |
|---|---|
| PubChem CID | 165095817 |
| Molecular Formula | C178H158N6 |
| Molecular Weight | 2381.26 g/mol |
| Exact Mass | 2379.25 |
| IUPAC Name | 7-cyclohexyl-N,N-bis(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-amine;7-cyclohexyl-N-(7-cyclohexyl-9,9-dimethylfluoren-2-yl)-N-(9,9-dimethylfluoren-2-yl)-9-phenylcarbazol-3-amine;7-cyclohexyl-N-(9,9-dimethylfluoren-2-yl)-N-(9,9-diphenylfluoren-2-yl)-9-phenylcarbazol-3-amine |
| SMILES | CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3cc(C5CCCCC5)ccc3-4)c3ccc4c(c3)c3ccc(C5CCCCC5)cc3n4-c3ccccc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)c3ccc(C5CCCCC5)cc3n4-c3ccccc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)c3ccc4c(c3)c3ccc(C5CCCCC5)cc3n4-c3ccccc3)cc21 |
| InChI | InChI=1S/C64H52N2.C60H58N2.C54H48N2/c1-63(2)57-29-17-15-27-51(57)53-36-32-49(41-59(53)63)65(48-34-38-61-56(40-48)55-35-31-44(43-19-7-3-8-20-43)39-62(55)66(61)47-25-13-6-14-26-47)50-33-37-54-52-28-16-18-30-58(52)64(60(54)42-50,45-21-9-4-10-22-45)46-23-11-5-12-24-46;1-59(2)53-23-15-14-22-47(53)49-31-26-45(37-55(49)59)61(46-27-32-50-48-29-24-41(39-16-8-5-9-17-39)34-54(48)60(3,4)56(50)38-46)44-28-33-57-52(36-44)51-30-25-42(40-18-10-6-11-19-40)35-58(51)62(57)43-20-12-7-13-21-43;1-53(2)47-21-13-11-19-41(47)43-28-24-39(33-49(43)53)55(40-25-29-44-42-20-12-14-22-48(42)54(3,4)50(44)34-40)38-26-30-51-46(32-38)45-27-23-36(35-15-7-5-8-16-35)31-52(45)56(51)37-17-9-6-10-18-37/h4-6,9-18,21-43H,3,7-8,19-20H2,1-2H3;7,12-15,20-40H,5-6,8-11,16-19H2,1-4H3;6,9-14,17-35H,5,7-8,15-16H2,1-4H3 |
| InChIKey | XMFMFCABQRLPQY-UHFFFAOYSA-N |
| XLogP | 48.85 |
| TPSA | 24.51 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 184 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2381.26 |
| LogP ≤ 5 | 48.85 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |