C127H197Cl3N26O11 — CID 158066551
2-(1-tert-butylpyrrolidin-3-yl)oxypyridine;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;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine (PubChem CID 158066551) has the molecular formula C127H197Cl3N26O11 and a molecular weight of 2370.50 g/mol. Its IUPAC name is 2-(1-tert-butylpyrrolidin-3-yl)oxypyridine;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;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine.
| Compound Name | 2-(1-tert-butylpyrrolidin-3-yl)oxypyridine;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;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine |
|---|---|
| PubChem CID | 158066551 |
| Molecular Formula | C127H197Cl3N26O11 |
| Molecular Weight | 2370.50 g/mol |
| Exact Mass | 2367.47 |
| IUPAC Name | 2-(1-tert-butylpyrrolidin-3-yl)oxypyridine;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;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;3-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;5-methyl-2-(1-propan-2-ylazetidin-3-yl)oxypyridine;4-(6-methylpyridazin-3-yl)oxy-1-propan-2-ylpiperidin-3-amine;2-(1-propan-2-ylpiperidin-4-yl)oxypyrimidine |
| SMILES | CC(C)(C)N1CCC(Oc2ccccn2)C1.CC(C)N1CC(N)C(Oc2ccc(Cl)nn2)C1.CC(C)N1CCC(Oc2ccc(Cl)cn2)CC1.CC(C)N1CCC(Oc2cncc(Cl)c2)CC1.CC(C)N1CCC(Oc2ncccn2)CC1.CCc1ccc(OC2CCN(C(C)C)CC2)nc1.COc1ccc(OC2CN(C(C)C)CC2N)cn1.Cc1ccc(OC2CCN(C(C)C)CC2N)nn1.Cc1ccc(OC2CN(C(C)C)C2)nc1.Cc1cccnc1OC1CN(C(C)C)C1 |
| InChI | InChI=1S/C15H24N2O.2C13H19ClN2O.C13H22N4O.C13H21N3O2.C13H20N2O.C12H19N3O.2C12H18N2O.C11H17ClN4O/c1-4-13-5-6-15(16-11-13)18-14-7-9-17(10-8-14)12(2)3;1-10(2)16-5-3-12(4-6-16)17-13-7-11(14)8-15-9-13;1-10(2)16-7-5-12(6-8-16)17-13-4-3-11(14)9-15-13;1-9(2)17-7-6-12(11(14)8-17)18-13-5-4-10(3)15-16-13;1-9(2)16-7-11(14)12(8-16)18-10-4-5-13(17-3)15-6-10;1-13(2,3)15-9-7-11(10-15)16-12-6-4-5-8-14-12;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;1-7(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;7-10,12H,3-6H2,1-2H3;3-4,9-10,12H,5-8H2,1-2H3;4-5,9,11-12H,6-8,14H2,1-3H3;4-6,9,11-12H,7-8,14H2,1-3H3;4-6,8,11H,7,9-10H2,1-3H3;3,6-7,10-11H,4-5,8-9H2,1-2H3;2*4-6,9,11H,7-8H2,1-3H3;3-4,7-9H,5-6,13H2,1-2H3 |
| InChIKey | FLHJKFMRUJFBRQ-UHFFFAOYSA-N |
| XLogP | 19.44 |
| TPSA | 379.56 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 37 |
| Rotatable Bonds | 31 |
| Heavy Atoms | 167 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2370.50 |
| LogP ≤ 5 | 19.44 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 37 |