C100H187F5N20O10 — CID 157185327
N-(1-tert-butylpiperidin-4-yl)-4,4-difluoropiperidine-1-carboxamide;N-(1-tert-butylpiperidin-4-yl)-4-hydroxypiperidine-1-carboxamide;3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;3-fluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide (PubChem CID 157185327) has the molecular formula C100H187F5N20O10 and a molecular weight of 1924.72 g/mol. Its IUPAC name is N-(1-tert-butylpiperidin-4-yl)-4,4-difluoropiperidine-1-carboxamide;N-(1-tert-butylpiperidin-4-yl)-4-hydroxypiperidine-1-carboxamide;3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;3-fluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide.
| Compound Name | N-(1-tert-butylpiperidin-4-yl)-4,4-difluoropiperidine-1-carboxamide;N-(1-tert-butylpiperidin-4-yl)-4-hydroxypiperidine-1-carboxamide;3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;3-fluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide |
|---|---|
| PubChem CID | 157185327 |
| Molecular Formula | C100H187F5N20O10 |
| Molecular Weight | 1924.72 g/mol |
| Exact Mass | 1923.47 |
| IUPAC Name | N-(1-tert-butylpiperidin-4-yl)-4,4-difluoropiperidine-1-carboxamide;N-(1-tert-butylpiperidin-4-yl)-4-hydroxypiperidine-1-carboxamide;3,3-difluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;3-fluoro-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;4-methyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-1-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)morpholine-4-carboxamide;N-(1-propan-2-ylpiperidin-4-yl)oxane-4-carboxamide |
| SMILES | CC(C)(C)N1CCC(NC(=O)N2CCC(F)(F)CC2)CC1.CC(C)(C)N1CCC(NC(=O)N2CCC(O)CC2)CC1.CC(C)N1CCC(NC(=O)C2CCOCC2)CC1.CC(C)N1CCC(NC(=O)N2CCCC(F)(F)C2)CC1.CC(C)N1CCC(NC(=O)N2CCCC(F)C2)CC1.CC(C)N1CCC(NC(=O)N2CCOCC2)CC1.CC1CCN(C(=O)NC2CCN(C(C)C)CC2)CC1 |
| InChI | InChI=1S/C15H27F2N3O.C15H29N3O2.C15H29N3O.C14H25F2N3O.C14H26FN3O.C14H26N2O2.C13H25N3O2/c1-14(2,3)20-8-4-12(5-9-20)18-13(21)19-10-6-15(16,17)7-11-19;1-15(2,3)18-10-4-12(5-11-18)16-14(20)17-8-6-13(19)7-9-17;1-12(2)17-10-6-14(7-11-17)16-15(19)18-8-4-13(3)5-9-18;1-11(2)18-8-4-12(5-9-18)17-13(20)19-7-3-6-14(15,16)10-19;1-11(2)17-8-5-13(6-9-17)16-14(19)18-7-3-4-12(15)10-18;1-11(2)16-7-3-13(4-8-16)15-14(17)12-5-9-18-10-6-12;1-11(2)15-5-3-12(4-6-15)14-13(17)16-7-9-18-10-8-16/h12H,4-11H2,1-3H3,(H,18,21);12-13,19H,4-11H2,1-3H3,(H,16,20);12-14H,4-11H2,1-3H3,(H,16,19);11-12H,3-10H2,1-2H3,(H,17,20);11-13H,3-10H2,1-2H3,(H,16,19);11-13H,3-10H2,1-2H3,(H,15,17);11-12H,3-10H2,1-2H3,(H,14,17) |
| InChIKey | APAYZIFWFNVXPK-UHFFFAOYSA-N |
| XLogP | 13.01 |
| TPSA | 284.51 Ų |
| H-Bond Donors | 8 |
| H-Bond Acceptors | 17 |
| Rotatable Bonds | 13 |
| Heavy Atoms | 135 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1924.72 |
| LogP ≤ 5 | 13.01 |
| H-Bond Donors ≤ 5 | 8 |
| H-Bond Acceptors ≤ 10 | 17 |