C143H228ClFN22O11 — CID 158194148
3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(3-chloro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(5-methylpyrazin-2-yl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methyl-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;1-propan-2-yl-4-(pyridin-3-ylmethyl)piperidin-4-ol (PubChem CID 158194148) has the molecular formula C143H228ClFN22O11 and a molecular weight of 2485.99 g/mol. Its IUPAC name is 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(3-chloro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(5-methylpyrazin-2-yl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methyl-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;1-propan-2-yl-4-(pyridin-3-ylmethyl)piperidin-4-ol.
| Compound Name | 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(3-chloro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(5-methylpyrazin-2-yl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methyl-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;1-propan-2-yl-4-(pyridin-3-ylmethyl)piperidin-4-ol |
|---|---|
| PubChem CID | 158194148 |
| Molecular Formula | C143H228ClFN22O11 |
| Molecular Weight | 2485.99 g/mol |
| Exact Mass | 2483.76 |
| IUPAC Name | 3-amino-4-hydroxy-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-4-methyl-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]pentan-2-one;3-amino-1-[1-propan-2-yl-4-(pyridin-2-ylmethyl)piperidin-4-yl]butan-2-one;4-[(3-chloro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(3-fluoro-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methoxy-3-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(5-methylpyrazin-2-yl)methyl]-1-propan-2-ylpiperidin-4-ol;4-[(6-methyl-2-pyridinyl)methyl]-1-propan-2-ylpiperidin-4-ol;1-propan-2-yl-4-(pyridin-3-ylmethyl)piperidin-4-ol |
| SMILES | CC(C)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(C)N1CCC(O)(Cc2cccnc2)CC1.CC(C)N1CCC(O)(Cc2ncccc2Cl)CC1.CC(C)N1CCC(O)(Cc2ncccc2F)CC1.CC(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.CC(O)C(N)C(=O)CC1(Cc2ccccn2)CCN(C(C)C)CC1.COc1ccc(CC2(O)CCN(C(C)C)CC2)cn1.Cc1cccc(CC2(O)CCN(C(C)C)CC2)n1.Cc1cnc(CC2(O)CCN(C(C)C)CC2)cn1 |
| InChI | InChI=1S/C20H33N3O.C19H31N3O2.C18H29N3O.C15H24N2O2.C15H24N2O.C14H21ClN2O.C14H21FN2O.C14H23N3O.C14H22N2O/c1-15(2)19(21)18(24)14-20(13-17-7-5-6-10-22-17)8-11-23(12-9-20)16(3)4;1-14(2)22-10-7-19(8-11-22,12-16-6-4-5-9-21-16)13-17(24)18(20)15(3)23;1-14(2)21-10-7-18(8-11-21,13-17(22)15(3)19)12-16-6-4-5-9-20-16;1-12(2)17-8-6-15(18,7-9-17)10-13-4-5-14(19-3)16-11-13;1-12(2)17-9-7-15(18,8-10-17)11-14-6-4-5-13(3)16-14;2*1-11(2)17-8-5-14(18,6-9-17)10-13-12(15)4-3-7-16-13;1-11(2)17-6-4-14(18,5-7-17)8-13-10-15-12(3)9-16-13;1-12(2)16-8-5-14(17,6-9-16)10-13-4-3-7-15-11-13/h5-7,10,15-16,19H,8-9,11-14,21H2,1-4H3;4-6,9,14-15,18,23H,7-8,10-13,20H2,1-3H3;4-6,9,14-15H,7-8,10-13,19H2,1-3H3;4-5,11-12,18H,6-10H2,1-3H3;4-6,12,18H,7-11H2,1-3H3;2*3-4,7,11,18H,5-6,8-10H2,1-2H3;9-11,18H,4-8H2,1-3H3;3-4,7,11-12,17H,5-6,8-10H2,1-2H3 |
| InChIKey | GADDGGOOKFOGKW-UHFFFAOYSA-N |
| XLogP | 19.23 |
| TPSA | 438.17 Ų |
| H-Bond Donors | 10 |
| H-Bond Acceptors | 33 |
| Rotatable Bonds | 39 |
| Heavy Atoms | 178 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2485.99 |
| LogP ≤ 5 | 19.23 |
| H-Bond Donors ≤ 5 | 10 |
| H-Bond Acceptors ≤ 10 | 33 |