C96H148ClFN22O10 — CID 158022962
4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;4-[(5-fluoro-6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;3-methyl-6-(1-propan-2-ylpiperidin-4-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-(1-propan-2-ylazetidin-3-yl)oxypyridine;1-propan-2-yl-4-pyridin-2-yloxypyrrolidin-3-amine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine (PubChem CID 158022962) has the molecular formula C96H148ClFN22O10 and a molecular weight of 1824.83 g/mol. Its IUPAC name is 4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;4-[(5-fluoro-6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;3-methyl-6-(1-propan-2-ylpiperidin-4-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-(1-propan-2-ylazetidin-3-yl)oxypyridine;1-propan-2-yl-4-pyridin-2-yloxypyrrolidin-3-amine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine.
| Compound Name | 4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;4-[(5-fluoro-6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;3-methyl-6-(1-propan-2-ylpiperidin-4-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-(1-propan-2-ylazetidin-3-yl)oxypyridine;1-propan-2-yl-4-pyridin-2-yloxypyrrolidin-3-amine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine |
|---|---|
| PubChem CID | 158022962 |
| Molecular Formula | C96H148ClFN22O10 |
| Molecular Weight | 1824.83 g/mol |
| Exact Mass | 1823.14 |
| IUPAC Name | 4-(6-chloropyridazin-3-yl)oxy-1-propan-2-ylpyrrolidin-3-amine;4-[(5-fluoro-6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;4-[(6-methoxy-3-pyridinyl)oxy]-1-propan-2-ylpyrrolidin-3-amine;3-methyl-6-(1-propan-2-ylpiperidin-4-yl)oxypyridazine;2-(1-propan-2-ylazetidin-3-yl)oxypyridine;3-(1-propan-2-ylazetidin-3-yl)oxypyridine;1-propan-2-yl-4-pyridin-2-yloxypyrrolidin-3-amine;2-(1-propan-2-ylpyrrolidin-3-yl)oxypyridine |
| SMILES | CC(C)N1CC(N)C(Oc2ccc(Cl)nn2)C1.CC(C)N1CC(N)C(Oc2ccccn2)C1.CC(C)N1CC(Oc2ccccn2)C1.CC(C)N1CC(Oc2cccnc2)C1.CC(C)N1CCC(Oc2ccccn2)C1.COc1ccc(OC2CN(C(C)C)CC2N)cn1.COc1ncc(OC2CN(C(C)C)CC2N)cc1F.Cc1ccc(OC2CCN(C(C)C)CC2)nn1 |
| InChI | InChI=1S/C13H20FN3O2.C13H21N3O2.C13H21N3O.C12H19N3O.C12H18N2O.C11H17ClN4O.2C11H16N2O/c1-8(2)17-6-11(15)12(7-17)19-9-4-10(14)13(18-3)16-5-9;1-9(2)16-7-11(14)12(8-16)18-10-4-5-13(17-3)15-6-10;1-10(2)16-8-6-12(7-9-16)17-13-5-4-11(3)14-15-13;1-9(2)15-7-10(13)11(8-15)16-12-5-3-4-6-14-12;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;1-9(2)13-7-11(8-13)14-10-4-3-5-12-6-10;1-9(2)13-7-10(8-13)14-11-5-3-4-6-12-11/h4-5,8,11-12H,6-7,15H2,1-3H3;4-6,9,11-12H,7-8,14H2,1-3H3;4-5,10,12H,6-9H2,1-3H3;3-6,9-11H,7-8,13H2,1-2H3;3-5,7,10-11H,6,8-9H2,1-2H3;3-4,7-9H,5-6,13H2,1-2H3;3-6,9,11H,7-8H2,1-2H3;3-6,9-10H,7-8H2,1-2H3 |
| InChIKey | FGGRIFJYLWTNLW-UHFFFAOYSA-N |
| XLogP | 10.81 |
| TPSA | 351.20 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 32 |
| Rotatable Bonds | 26 |
| Heavy Atoms | 130 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1824.83 |
| LogP ≤ 5 | 10.81 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 32 |