C101H189F6N21O8 — CID 165067608
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-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)piperidine-1-carboxamide (PubChem CID 165067608) has the molecular formula C101H189F6N21O8 and a molecular weight of 1939.75 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-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)piperidine-1-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-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)piperidine-1-carboxamide |
|---|---|
| PubChem CID | 165067608 |
| Molecular Formula | C101H189F6N21O8 |
| Molecular Weight | 1939.75 g/mol |
| Exact Mass | 1938.49 |
| 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-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)piperidine-1-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)N2CCC(F)CC2)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)N2CCCCC2)CC1.CC1CCN(C(=O)NC2CCN(C(C)C)CC2)CC1 |
| InChI | InChI=1S/C15H27F2N3O.C15H29N3O2.C15H29N3O.C14H25F2N3O.2C14H26FN3O.C14H27N3O/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)17-9-5-13(6-10-17)16-14(19)18-7-3-12(15)4-8-18;1-11(2)17-8-5-13(6-9-17)16-14(19)18-7-3-4-12(15)10-18;1-12(2)16-10-6-13(7-11-16)15-14(18)17-8-4-3-5-9-17/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);2*11-13H,3-10H2,1-2H3,(H,16,19);12-13H,3-11H2,1-2H3,(H,15,18) |
| InChIKey | SFNOPHOZSYHPLG-UHFFFAOYSA-N |
| XLogP | 14.77 |
| TPSA | 269.29 Ų |
| H-Bond Donors | 8 |
| H-Bond Acceptors | 15 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 136 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1939.75 |
| LogP ≤ 5 | 14.77 |
| H-Bond Donors ≤ 5 | 8 |
| H-Bond Acceptors ≤ 10 | 15 |