C116H242N18O5 — CID 158351879
2-[2-[2-[ethyl(methyl)amino]propan-2-yl]piperidin-1-yl]ethanol;3-(1-ethylpiperidin-2-yl)pentan-3-amine;2-(1-ethylpiperidin-2-yl)-2-pyrrolidin-1-ylbutan-1-ol;1-ethyl-2-(3-pyrrolidin-1-ylpentan-3-yl)piperidine;1-(2-hydroxyethyl)-6-(1-piperidin-1-ylcyclohexyl)piperidin-3-ol;2-[2-[3-(methylamino)hexan-3-yl]piperidin-1-yl]ethanol;3-(1-methylpiperidin-2-yl)pentan-3-amine;2-(1-methylpiperidin-2-yl)propan-2-amine;2-piperidin-2-ylpropan-2-amine (PubChem CID 158351879) has the molecular formula C116H242N18O5 and a molecular weight of 1969.33 g/mol. Its IUPAC name is 2-[2-[2-[ethyl(methyl)amino]propan-2-yl]piperidin-1-yl]ethanol;3-(1-ethylpiperidin-2-yl)pentan-3-amine;2-(1-ethylpiperidin-2-yl)-2-pyrrolidin-1-ylbutan-1-ol;1-ethyl-2-(3-pyrrolidin-1-ylpentan-3-yl)piperidine;1-(2-hydroxyethyl)-6-(1-piperidin-1-ylcyclohexyl)piperidin-3-ol;2-[2-[3-(methylamino)hexan-3-yl]piperidin-1-yl]ethanol;3-(1-methylpiperidin-2-yl)pentan-3-amine;2-(1-methylpiperidin-2-yl)propan-2-amine;2-piperidin-2-ylpropan-2-amine.
| Compound Name | 2-[2-[2-[ethyl(methyl)amino]propan-2-yl]piperidin-1-yl]ethanol;3-(1-ethylpiperidin-2-yl)pentan-3-amine;2-(1-ethylpiperidin-2-yl)-2-pyrrolidin-1-ylbutan-1-ol;1-ethyl-2-(3-pyrrolidin-1-ylpentan-3-yl)piperidine;1-(2-hydroxyethyl)-6-(1-piperidin-1-ylcyclohexyl)piperidin-3-ol;2-[2-[3-(methylamino)hexan-3-yl]piperidin-1-yl]ethanol;3-(1-methylpiperidin-2-yl)pentan-3-amine;2-(1-methylpiperidin-2-yl)propan-2-amine;2-piperidin-2-ylpropan-2-amine |
|---|---|
| PubChem CID | 158351879 |
| Molecular Formula | C116H242N18O5 |
| Molecular Weight | 1969.33 g/mol |
| Exact Mass | 1967.92 |
| IUPAC Name | 2-[2-[2-[ethyl(methyl)amino]propan-2-yl]piperidin-1-yl]ethanol;3-(1-ethylpiperidin-2-yl)pentan-3-amine;2-(1-ethylpiperidin-2-yl)-2-pyrrolidin-1-ylbutan-1-ol;1-ethyl-2-(3-pyrrolidin-1-ylpentan-3-yl)piperidine;1-(2-hydroxyethyl)-6-(1-piperidin-1-ylcyclohexyl)piperidin-3-ol;2-[2-[3-(methylamino)hexan-3-yl]piperidin-1-yl]ethanol;3-(1-methylpiperidin-2-yl)pentan-3-amine;2-(1-methylpiperidin-2-yl)propan-2-amine;2-piperidin-2-ylpropan-2-amine |
| SMILES | CC(C)(N)C1CCCCN1.CCC(N)(CC)C1CCCCN1C.CCCC(CC)(NC)C1CCCCN1CCO.CCN(C)C(C)(C)C1CCCCN1CCO.CCN1CCCCC1C(CC)(CC)N1CCCC1.CCN1CCCCC1C(CC)(CO)N1CCCC1.CCN1CCCCC1C(N)(CC)CC.CN1CCCCC1C(C)(C)N.OCCN1CC(O)CCC1C1(N2CCCCC2)CCCCC1 |
| InChI | InChI=1S/C18H34N2O2.C16H32N2.C15H30N2O.C14H30N2O.C13H28N2O.C12H26N2.C11H24N2.C9H20N2.C8H18N2/c21-14-13-19-15-16(22)7-8-17(19)18(9-3-1-4-10-18)20-11-5-2-6-12-20;1-4-16(5-2,18-13-9-10-14-18)15-11-7-8-12-17(15)6-3;1-3-15(13-18,17-11-7-8-12-17)14-9-5-6-10-16(14)4-2;1-4-9-14(5-2,15-3)13-8-6-7-10-16(13)11-12-17;1-5-14(4)13(2,3)12-8-6-7-9-15(12)10-11-16;1-4-12(13,5-2)11-9-7-8-10-14(11)6-3;1-4-11(12,5-2)10-8-6-7-9-13(10)3;1-9(2,10)8-6-4-5-7-11(8)3;1-8(2,9)7-5-3-4-6-10-7/h16-17,21-22H,1-15H2;15H,4-14H2,1-3H3;14,18H,3-13H2,1-2H3;13,15,17H,4-12H2,1-3H3;12,16H,5-11H2,1-4H3;11H,4-10,13H2,1-3H3;10H,4-9,12H2,1-3H3;8H,4-7,10H2,1-3H3;7,10H,3-6,9H2,1-2H3 |
| InChIKey | GSKMDAWYQCAZFH-UHFFFAOYSA-N |
| XLogP | 17.61 |
| TPSA | 268.17 Ų |
| H-Bond Donors | 11 |
| H-Bond Acceptors | 23 |
| Rotatable Bonds | 35 |
| Heavy Atoms | 139 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1969.33 |
| LogP ≤ 5 | 17.61 |
| H-Bond Donors ≤ 5 | 11 |
| H-Bond Acceptors ≤ 10 | 23 |