C165H250N22O12 — CID 158700167
5-(1,4-dimethylpiperidin-4-yl)-2-propan-2-ylpyridine;(2R)-2-(methoxymethyl)-4-(6-propan-2-yl-3-pyridinyl)morpholine;(2S)-2-(methoxymethyl)-4-(6-propan-2-yl-3-pyridinyl)morpholine;5-(4-methylpiperidin-4-yl)-2-propan-2-ylpyridine;1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;(4S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;(4R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;5-(oxan-4-yl)-2-propan-2-ylpyridine;5-piperidin-4-yl-2-propan-2-ylpyridine;4-[(6-propan-2-yl-3-pyridinyl)methyl]morpholine;4-(6-propan-2-yl-3-pyridinyl)oxan-4-ol (PubChem CID 158700167) has the molecular formula C165H250N22O12 and a molecular weight of 2733.96 g/mol. Its IUPAC name is 5-(1,4-dimethylpiperidin-4-yl)-2-propan-2-ylpyridine;(2R)-2-(methoxymethyl)-4-(6-propan-2-yl-3-pyridinyl)morpholine;(2S)-2-(methoxymethyl)-4-(6-propan-2-yl-3-pyridinyl)morpholine;5-(4-methylpiperidin-4-yl)-2-propan-2-ylpyridine;1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;(4S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;(4R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;5-(oxan-4-yl)-2-propan-2-ylpyridine;5-piperidin-4-yl-2-propan-2-ylpyridine;4-[(6-propan-2-yl-3-pyridinyl)methyl]morpholine;4-(6-propan-2-yl-3-pyridinyl)oxan-4-ol.
| Compound Name | 5-(1,4-dimethylpiperidin-4-yl)-2-propan-2-ylpyridine;(2R)-2-(methoxymethyl)-4-(6-propan-2-yl-3-pyridinyl)morpholine;(2S)-2-(methoxymethyl)-4-(6-propan-2-yl-3-pyridinyl)morpholine;5-(4-methylpiperidin-4-yl)-2-propan-2-ylpyridine;1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;(4S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;(4R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;5-(oxan-4-yl)-2-propan-2-ylpyridine;5-piperidin-4-yl-2-propan-2-ylpyridine;4-[(6-propan-2-yl-3-pyridinyl)methyl]morpholine;4-(6-propan-2-yl-3-pyridinyl)oxan-4-ol |
|---|---|
| PubChem CID | 158700167 |
| Molecular Formula | C165H250N22O12 |
| Molecular Weight | 2733.96 g/mol |
| Exact Mass | 2731.96 |
| IUPAC Name | 5-(1,4-dimethylpiperidin-4-yl)-2-propan-2-ylpyridine;(2R)-2-(methoxymethyl)-4-(6-propan-2-yl-3-pyridinyl)morpholine;(2S)-2-(methoxymethyl)-4-(6-propan-2-yl-3-pyridinyl)morpholine;5-(4-methylpiperidin-4-yl)-2-propan-2-ylpyridine;1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-4-ol;1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;(4S)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;(4R)-1-methyl-4-(6-propan-2-yl-3-pyridinyl)piperidin-2-one;5-(oxan-4-yl)-2-propan-2-ylpyridine;5-piperidin-4-yl-2-propan-2-ylpyridine;4-[(6-propan-2-yl-3-pyridinyl)methyl]morpholine;4-(6-propan-2-yl-3-pyridinyl)oxan-4-ol |
| SMILES | CC(C)c1ccc(C2(C)CCN(C)CC2)cn1.CC(C)c1ccc(C2(C)CCNCC2)cn1.CC(C)c1ccc(C2(O)CCN(C)CC2)cn1.CC(C)c1ccc(C2(O)CCOCC2)cn1.CC(C)c1ccc(C2CCN(C)C(=O)C2)cn1.CC(C)c1ccc(C2CCNCC2)cn1.CC(C)c1ccc(C2CCOCC2)cn1.CC(C)c1ccc(CN2CCOCC2)cn1.CC(C)c1ccc([C@@H]2CCN(C)C(=O)C2)cn1.CC(C)c1ccc([C@H]2CCN(C)C(=O)C2)cn1.COC[C@@H]1CN(c2ccc(C(C)C)nc2)CCO1.COC[C@H]1CN(c2ccc(C(C)C)nc2)CCO1 |
| InChI | InChI=1S/C15H24N2.2C14H22N2O2.C14H22N2O.3C14H20N2O.C14H22N2.C13H20N2O.C13H20N2.C13H19NO2.C13H19NO/c1-12(2)14-6-5-13(11-16-14)15(3)7-9-17(4)10-8-15;2*1-11(2)14-5-4-12(8-15-14)16-6-7-18-13(9-16)10-17-3;1-11(2)13-5-4-12(10-15-13)14(17)6-8-16(3)9-7-14;3*1-10(2)13-5-4-12(9-15-13)11-6-7-16(3)14(17)8-11;1-11(2)13-5-4-12(10-16-13)14(3)6-8-15-9-7-14;1-11(2)13-4-3-12(9-14-13)10-15-5-7-16-8-6-15;1-10(2)13-4-3-12(9-15-13)11-5-7-14-8-6-11;1-10(2)12-4-3-11(9-14-12)13(15)5-7-16-8-6-13;1-10(2)13-4-3-12(9-14-13)11-5-7-15-8-6-11/h5-6,11-12H,7-10H2,1-4H3;2*4-5,8,11,13H,6-7,9-10H2,1-3H3;4-5,10-11,17H,6-9H2,1-3H3;3*4-5,9-11H,6-8H2,1-3H3;4-5,10-11,15H,6-9H2,1-3H3;3-4,9,11H,5-8,10H2,1-2H3;3-4,9-11,14H,5-8H2,1-2H3;3-4,9-10,15H,5-8H2,1-2H3;3-4,9-11H,5-8H2,1-2H3/t;2*13-;;2*11-;;;;;;/m.10.10....../s1 |
| InChIKey | IHLDXKCSWPAIDH-DPADDFJVSA-N |
| XLogP | 29.90 |
| TPSA | 360.94 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 31 |
| Rotatable Bonds | 29 |
| Heavy Atoms | 199 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2733.96 |
| LogP ≤ 5 | 29.90 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 31 |