C168H215F2N17O8 — CID 161426298
N-[[1-[2-(1-benzofuran-2-yl)propan-2-yl]piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(2-fluoro-3-methylphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(2-fluorophenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[2-methyl-1-(4-methylphenyl)propan-2-yl]piperidin-4-yl]methyl]-1H-indene-2-carboxamide;N-ethyl-N-[[1-[2-methyl-1-(4-methylphenyl)propan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide (PubChem CID 161426298) has the molecular formula C168H215F2N17O8 and a molecular weight of 2638.67 g/mol. Its IUPAC name is N-[[1-[2-(1-benzofuran-2-yl)propan-2-yl]piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(2-fluoro-3-methylphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(2-fluorophenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[2-methyl-1-(4-methylphenyl)propan-2-yl]piperidin-4-yl]methyl]-1H-indene-2-carboxamide;N-ethyl-N-[[1-[2-methyl-1-(4-methylphenyl)propan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide.
| Compound Name | N-[[1-[2-(1-benzofuran-2-yl)propan-2-yl]piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(2-fluoro-3-methylphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(2-fluorophenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[2-methyl-1-(4-methylphenyl)propan-2-yl]piperidin-4-yl]methyl]-1H-indene-2-carboxamide;N-ethyl-N-[[1-[2-methyl-1-(4-methylphenyl)propan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide |
|---|---|
| PubChem CID | 161426298 |
| Molecular Formula | C168H215F2N17O8 |
| Molecular Weight | 2638.67 g/mol |
| Exact Mass | 2636.69 |
| IUPAC Name | N-[[1-[2-(1-benzofuran-2-yl)propan-2-yl]piperidin-4-yl]methyl]-N-ethyl-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(2-fluoro-3-methylphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(2-fluorophenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[1-(4-methoxyphenyl)-2-methylpropan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide;N-ethyl-N-[[1-[2-methyl-1-(4-methylphenyl)propan-2-yl]piperidin-4-yl]methyl]-1H-indene-2-carboxamide;N-ethyl-N-[[1-[2-methyl-1-(4-methylphenyl)propan-2-yl]piperidin-4-yl]methyl]-1H-indole-2-carboxamide |
| SMILES | CCN(CC1CCN(C(C)(C)Cc2ccc(C)cc2)CC1)C(=O)C1=Cc2ccccc2C1.CCN(CC1CCN(C(C)(C)Cc2ccc(C)cc2)CC1)C(=O)c1cc2ccccc2[nH]1.CCN(CC1CCN(C(C)(C)Cc2ccc(OC)cc2)CC1)C(=O)c1cc2ccccc2[nH]1.CCN(CC1CCN(C(C)(C)Cc2cccc(C)c2F)CC1)C(=O)c1cc2ccccc2[nH]1.CCN(CC1CCN(C(C)(C)Cc2ccccc2F)CC1)C(=O)c1cc2ccccc2[nH]1.CCN(CC1CCN(C(C)(C)c2cc3ccccc3o2)CC1)C(=O)c1cc2ccccc2[nH]1 |
| InChI | InChI=1S/C29H38N2O.C28H36FN3O.C28H33N3O2.C28H37N3O2.C28H37N3O.C27H34FN3O/c1-5-30(28(32)27-18-25-8-6-7-9-26(25)19-27)21-24-14-16-31(17-15-24)29(3,4)20-23-12-10-22(2)11-13-23;1-5-31(27(33)25-17-22-10-6-7-12-24(22)30-25)19-21-13-15-32(16-14-21)28(3,4)18-23-11-8-9-20(2)26(23)29;1-4-30(27(32)24-17-21-9-5-7-11-23(21)29-24)19-20-13-15-31(16-14-20)28(2,3)26-18-22-10-6-8-12-25(22)33-26;1-5-30(27(32)26-18-23-8-6-7-9-25(23)29-26)20-22-14-16-31(17-15-22)28(2,3)19-21-10-12-24(33-4)13-11-21;1-5-30(27(32)26-18-24-8-6-7-9-25(24)29-26)20-23-14-16-31(17-15-23)28(3,4)19-22-12-10-21(2)11-13-22;1-4-30(26(32)25-17-21-9-6-8-12-24(21)29-25)19-20-13-15-31(16-14-20)27(2,3)18-22-10-5-7-11-23(22)28/h6-13,18,24H,5,14-17,19-21H2,1-4H3;6-12,17,21,30H,5,13-16,18-19H2,1-4H3;5-12,17-18,20,29H,4,13-16,19H2,1-3H3;6-13,18,22,29H,5,14-17,19-20H2,1-4H3;6-13,18,23,29H,5,14-17,19-20H2,1-4H3;5-12,17,20,29H,4,13-16,18-19H2,1-3H3 |
| InChIKey | VXKCRMDCDHVEDP-UHFFFAOYSA-N |
| XLogP | 33.90 |
| TPSA | 242.62 Ų |
| H-Bond Donors | 5 |
| H-Bond Acceptors | 14 |
| Rotatable Bonds | 42 |
| Heavy Atoms | 195 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2638.67 |
| LogP ≤ 5 | 33.90 |
| H-Bond Donors ≤ 5 | 5 |
| H-Bond Acceptors ≤ 10 | 14 |