C103H126F4N12O5 — CID 162073091
N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-fluorophenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-methoxyphenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-methylphenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-[4-(trifluoromethyl)phenyl]indol-1-yl]acetamide (PubChem CID 162073091) has the molecular formula C103H126F4N12O5 and a molecular weight of 1688.21 g/mol. Its IUPAC name is N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-fluorophenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-methoxyphenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-methylphenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-[4-(trifluoromethyl)phenyl]indol-1-yl]acetamide.
| Compound Name | N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-fluorophenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-methoxyphenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-methylphenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-[4-(trifluoromethyl)phenyl]indol-1-yl]acetamide |
|---|---|
| PubChem CID | 162073091 |
| Molecular Formula | C103H126F4N12O5 |
| Molecular Weight | 1688.21 g/mol |
| Exact Mass | 1686.99 |
| IUPAC Name | N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-fluorophenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-methoxyphenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-(4-methylphenyl)indol-1-yl]acetamide;N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[6-[4-(trifluoromethyl)phenyl]indol-1-yl]acetamide |
| SMILES | CN(CCNC(=O)Cn1ccc2ccc(-c3ccc(C(F)(F)F)cc3)cc21)C1CCCCC1.CN(CCNC(=O)Cn1ccc2ccc(-c3ccc(F)cc3)cc21)C1CCCCC1.COc1ccc(-c2ccc3ccn(CC(=O)NCCN(C)C4CCCCC4)c3c2)cc1.Cc1ccc(-c2ccc3ccn(CC(=O)NCCN(C)C4CCCCC4)c3c2)cc1 |
| InChI | InChI=1S/C26H30F3N3O.C26H33N3O2.C26H33N3O.C25H30FN3O/c1-31(23-5-3-2-4-6-23)16-14-30-25(33)18-32-15-13-20-7-8-21(17-24(20)32)19-9-11-22(12-10-19)26(27,28)29;1-28(23-6-4-3-5-7-23)17-15-27-26(30)19-29-16-14-21-8-9-22(18-25(21)29)20-10-12-24(31-2)13-11-20;1-20-8-10-21(11-9-20)23-13-12-22-14-16-29(25(22)18-23)19-26(30)27-15-17-28(2)24-6-4-3-5-7-24;1-28(23-5-3-2-4-6-23)16-14-27-25(30)18-29-15-13-20-7-8-21(17-24(20)29)19-9-11-22(26)12-10-19/h7-13,15,17,23H,2-6,14,16,18H2,1H3,(H,30,33);8-14,16,18,23H,3-7,15,17,19H2,1-2H3,(H,27,30);8-14,16,18,24H,3-7,15,17,19H2,1-2H3,(H,27,30);7-13,15,17,23H,2-6,14,16,18H2,1H3,(H,27,30) |
| InChIKey | ZBISRXKQTMNFJS-UHFFFAOYSA-N |
| XLogP | 20.23 |
| TPSA | 158.31 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 13 |
| Rotatable Bonds | 29 |
| Heavy Atoms | 124 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1688.21 |
| LogP ≤ 5 | 20.23 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 13 |