C184H133N3 — CID 159519598
9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine;9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine (PubChem CID 159519598) has the molecular formula C184H133N3 and a molecular weight of 2386.11 g/mol. Its IUPAC name is 9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine;9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine.
| Compound Name | 9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine;9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine |
|---|---|
| PubChem CID | 159519598 |
| Molecular Formula | C184H133N3 |
| Molecular Weight | 2386.11 g/mol |
| Exact Mass | 2384.05 |
| IUPAC Name | 9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine;N-(2,4-diphenylphenyl)-9,9-dimethyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine;9,9-diphenyl-N-(4-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]spiro[anthracene-10,9'-fluorene]-2'-amine |
| SMILES | CC1(C)c2ccccc2C2(c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)cc32)c2ccccc21.CC1(C)c2ccccc2C2(c3ccccc3-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4-c4ccccc4)cc32)c2ccccc21.c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)C4(c6ccccc6-5)c5ccccc5C(c5ccccc5)(c5ccccc5)c5ccccc54)cc3)cc2)cc1 |
| InChI | InChI=1S/C68H47N.2C58H43N/c1-5-19-48(20-6-1)50-33-35-51(36-34-50)53-39-43-57(44-40-53)69(56-41-37-52(38-42-56)49-21-7-2-8-22-49)58-45-46-60-59-27-13-14-28-61(59)68(66(60)47-58)64-31-17-15-29-62(64)67(54-23-9-3-10-24-54,55-25-11-4-12-26-55)63-30-16-18-32-65(63)68;1-57(2)51-26-14-16-28-53(51)58(54-29-17-15-27-52(54)57)50-25-13-12-24-47(50)48-36-35-46(39-55(48)58)59(45-33-30-42(31-34-45)40-18-6-3-7-19-40)56-37-32-44(41-20-8-4-9-21-41)38-49(56)43-22-10-5-11-23-43;1-57(2)52-21-11-13-23-54(52)58(55-24-14-12-22-53(55)57)51-20-10-9-19-49(51)50-38-37-48(39-56(50)58)59(46-33-29-44(30-34-46)41-17-7-4-8-18-41)47-35-31-45(32-36-47)43-27-25-42(26-28-43)40-15-5-3-6-16-40/h1-47H;2*3-39H,1-2H3 |
| InChIKey | MBQFVMBGKFQSAH-UHFFFAOYSA-N |
| XLogP | 47.54 |
| TPSA | 9.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 20 |
| Heavy Atoms | 187 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2386.11 |
| LogP ≤ 5 | 47.54 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |