C105H173ClFN25O8 — CID 159780661
N-(1-tert-butyl-3-methylpyrrolidin-3-yl)-3-fluoropyridine-2-carboxamide;3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)imidazole-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide (PubChem CID 159780661) has the molecular formula C105H173ClFN25O8 and a molecular weight of 1968.16 g/mol. Its IUPAC name is N-(1-tert-butyl-3-methylpyrrolidin-3-yl)-3-fluoropyridine-2-carboxamide;3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)imidazole-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide.
| Compound Name | N-(1-tert-butyl-3-methylpyrrolidin-3-yl)-3-fluoropyridine-2-carboxamide;3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)imidazole-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide |
|---|---|
| PubChem CID | 159780661 |
| Molecular Formula | C105H173ClFN25O8 |
| Molecular Weight | 1968.16 g/mol |
| Exact Mass | 1966.36 |
| IUPAC Name | N-(1-tert-butyl-3-methylpyrrolidin-3-yl)-3-fluoropyridine-2-carboxamide;3-chloro-N-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-2-carboxamide;3,5-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)imidazole-4-carboxamide;1,3-dimethyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-4-carboxamide;2-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1,3-oxazole-4-carboxamide;1-methyl-N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyrazole-3-carboxamide;N-(4-methyl-1-propan-2-ylpiperidin-4-yl)-1-propan-2-ylpyrazole-4-carboxamide |
| SMILES | CC(C)N1CCC(C)(N(C)C(=O)c2ncccc2Cl)CC1.CC(C)N1CCC(C)(NC(=O)c2ccn(C)n2)CC1.CC(C)N1CCC(C)(NC(=O)c2cnn(C(C)C)c2)CC1.CC1(NC(=O)c2ncccc2F)CCN(C(C)(C)C)C1.Cc1nc(C(=O)NC2(C)CCN(C(C)C)CC2)co1.Cc1ncn(C)c1C(=O)NC1(C)CCN(C(C)C)CC1.Cc1nn(C)cc1C(=O)NC1(C)CCN(C(C)C)CC1 |
| InChI | InChI=1S/C16H24ClN3O.C16H28N4O.C15H22FN3O.2C15H26N4O.C14H24N4O.C14H23N3O2/c1-12(2)20-10-7-16(3,8-11-20)19(4)15(21)14-13(17)6-5-9-18-14;1-12(2)19-8-6-16(5,7-9-19)18-15(21)14-10-17-20(11-14)13(3)4;1-14(2,3)19-9-7-15(4,10-19)18-13(20)12-11(16)6-5-8-17-12;1-11(2)19-8-6-15(4,7-9-19)17-14(20)13-12(3)16-10-18(13)5;1-11(2)19-8-6-15(4,7-9-19)16-14(20)13-10-18(5)17-12(13)3;1-11(2)18-9-6-14(3,7-10-18)15-13(19)12-5-8-17(4)16-12;1-10(2)17-7-5-14(4,6-8-17)16-13(18)12-9-19-11(3)15-12/h5-6,9,12H,7-8,10-11H2,1-4H3;10-13H,6-9H2,1-5H3,(H,18,21);5-6,8H,7,9-10H2,1-4H3,(H,18,20);10-11H,6-9H2,1-5H3,(H,17,20);10-11H,6-9H2,1-5H3,(H,16,20);5,8,11H,6-7,9-10H2,1-4H3,(H,15,19);9-10H,5-8H2,1-4H3,(H,16,18) |
| InChIKey | NHHXKRADAJFWSR-UHFFFAOYSA-N |
| XLogP | 14.57 |
| TPSA | 340.68 Ų |
| H-Bond Donors | 6 |
| H-Bond Acceptors | 26 |
| Rotatable Bonds | 21 |
| Heavy Atoms | 140 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1968.16 |
| LogP ≤ 5 | 14.57 |
| H-Bond Donors ≤ 5 | 6 |
| H-Bond Acceptors ≤ 10 | 26 |