C127H190Cl3F4N23O10 — CID 167654462
3-chloro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-fluoro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-(1-propan-2-ylpiperidin-4-yl)oxy-5-(trifluoromethyl)pyridine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine (PubChem CID 167654462) has the molecular formula C127H190Cl3F4N23O10 and a molecular weight of 2381.42 g/mol. Its IUPAC name is 3-chloro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-fluoro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-(1-propan-2-ylpiperidin-4-yl)oxy-5-(trifluoromethyl)pyridine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine.
| Compound Name | 3-chloro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-fluoro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-(1-propan-2-ylpiperidin-4-yl)oxy-5-(trifluoromethyl)pyridine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine |
|---|---|
| PubChem CID | 167654462 |
| Molecular Formula | C127H190Cl3F4N23O10 |
| Molecular Weight | 2381.42 g/mol |
| Exact Mass | 2378.41 |
| IUPAC Name | 3-chloro-5-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-chloro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;5-ethyl-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;5-fluoro-2-(1-propan-2-ylpiperidin-4-yl)oxypyridine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine;2-(1-propan-2-ylpiperidin-4-yl)oxy-5-(trifluoromethyl)pyridine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine |
| SMILES | CC(C)N1CC(N)C(Oc2ccc(Cl)nn2)C1.CC(C)N1CCC(Oc2ccc(C(F)(F)F)cn2)CC1.CC(C)N1CCC(Oc2ccc(Cl)cn2)CC1.CC(C)N1CCC(Oc2ccc(F)cn2)CC1.CC(C)N1CCC(Oc2ccccn2)C1.CC(C)N1CCC(Oc2cncc(Cl)c2)CC1.CC(C)N1CCC(Oc2ncccn2)CC1.CCc1ccc(OC2CCN(C(C)C)CC2)nc1.Cc1ccc(OC2CN(C(C)C)C2)nc1.Cc1cccnc1OC1CN(C(C)C)C1 |
| InChI | InChI=1S/C15H24N2O.C14H19F3N2O.2C13H19ClN2O.C13H19FN2O.C12H19N3O.3C12H18N2O.C11H17ClN4O/c1-4-13-5-6-15(16-11-13)18-14-7-9-17(10-8-14)12(2)3;1-10(2)19-7-5-12(6-8-19)20-13-4-3-11(9-18-13)14(15,16)17;1-10(2)16-5-3-12(4-6-16)17-13-7-11(14)8-15-9-13;2*1-10(2)16-7-5-12(6-8-16)17-13-4-3-11(14)9-15-13;1-10(2)15-8-4-11(5-9-15)16-12-13-6-3-7-14-12;1-9(2)14-7-11(8-14)15-12-5-4-10(3)6-13-12;1-9(2)14-7-11(8-14)15-12-10(3)5-4-6-13-12;1-10(2)14-8-6-11(9-14)15-12-5-3-4-7-13-12;1-7(2)16-5-8(13)9(6-16)17-11-4-3-10(12)14-15-11/h5-6,11-12,14H,4,7-10H2,1-3H3;3-4,9-10,12H,5-8H2,1-2H3;7-10,12H,3-6H2,1-2H3;2*3-4,9-10,12H,5-8H2,1-2H3;3,6-7,10-11H,4-5,8-9H2,1-2H3;2*4-6,9,11H,7-8H2,1-3H3;3-5,7,10-11H,6,8-9H2,1-2H3;3-4,7-9H,5-6,13H2,1-2H3 |
| InChIKey | RAZPGEHXMBBFHB-UHFFFAOYSA-N |
| XLogP | 23.02 |
| TPSA | 305.40 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 33 |
| Rotatable Bonds | 31 |
| Heavy Atoms | 167 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2381.42 |
| LogP ≤ 5 | 23.02 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 33 |