C175H363N27O14 — CID 167634141
4-[2-(2-ethoxyethoxy)ethoxy]-1-propylpiperidine;4-(2-ethoxyethoxy)-1-(2-methylpropyl)piperidine;4-(2-ethoxyethyl)-1-propylpiperidine;1-[3-(1-ethylazetidin-3-yl)oxypropyl]-4-(2-methylpropyl)piperazine;1-ethyl-4-[[1-(2-methylpropyl)azetidin-3-yl]methyl]piperazine;1-ethyl-4-[1-(2-methylpropyl)azetidin-3-yl]piperazine;4-[2-(2-methoxyethoxy)ethoxy]-1-propylpiperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine;4-(2-methoxyethyl)-1-propylpiperidine;1-[3-(1-methylazetidin-3-yl)oxypropyl]-4-(2-methylpropyl)piperazine;1-methyl-4-[[1-(2-methylpropyl)azetidin-3-yl]methyl]piperazine;1-methyl-4-[1-(2-methylpropyl)azetidin-3-yl]piperazine;1-methyl-4-[3-[1-(2-methylpropyl)piperidin-4-yl]propyl]piperazine (PubChem CID 167634141) has the molecular formula C175H363N27O14 and a molecular weight of 3070.00 g/mol. Its IUPAC name is 4-[2-(2-ethoxyethoxy)ethoxy]-1-propylpiperidine;4-(2-ethoxyethoxy)-1-(2-methylpropyl)piperidine;4-(2-ethoxyethyl)-1-propylpiperidine;1-[3-(1-ethylazetidin-3-yl)oxypropyl]-4-(2-methylpropyl)piperazine;1-ethyl-4-[[1-(2-methylpropyl)azetidin-3-yl]methyl]piperazine;1-ethyl-4-[1-(2-methylpropyl)azetidin-3-yl]piperazine;4-[2-(2-methoxyethoxy)ethoxy]-1-propylpiperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine;4-(2-methoxyethyl)-1-propylpiperidine;1-[3-(1-methylazetidin-3-yl)oxypropyl]-4-(2-methylpropyl)piperazine;1-methyl-4-[[1-(2-methylpropyl)azetidin-3-yl]methyl]piperazine;1-methyl-4-[1-(2-methylpropyl)azetidin-3-yl]piperazine;1-methyl-4-[3-[1-(2-methylpropyl)piperidin-4-yl]propyl]piperazine.
| Compound Name | 4-[2-(2-ethoxyethoxy)ethoxy]-1-propylpiperidine;4-(2-ethoxyethoxy)-1-(2-methylpropyl)piperidine;4-(2-ethoxyethyl)-1-propylpiperidine;1-[3-(1-ethylazetidin-3-yl)oxypropyl]-4-(2-methylpropyl)piperazine;1-ethyl-4-[[1-(2-methylpropyl)azetidin-3-yl]methyl]piperazine;1-ethyl-4-[1-(2-methylpropyl)azetidin-3-yl]piperazine;4-[2-(2-methoxyethoxy)ethoxy]-1-propylpiperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine;4-(2-methoxyethyl)-1-propylpiperidine;1-[3-(1-methylazetidin-3-yl)oxypropyl]-4-(2-methylpropyl)piperazine;1-methyl-4-[[1-(2-methylpropyl)azetidin-3-yl]methyl]piperazine;1-methyl-4-[1-(2-methylpropyl)azetidin-3-yl]piperazine;1-methyl-4-[3-[1-(2-methylpropyl)piperidin-4-yl]propyl]piperazine |
|---|---|
| PubChem CID | 167634141 |
| Molecular Formula | C175H363N27O14 |
| Molecular Weight | 3070.00 g/mol |
| Exact Mass | 3067.85 |
| IUPAC Name | 4-[2-(2-ethoxyethoxy)ethoxy]-1-propylpiperidine;4-(2-ethoxyethoxy)-1-(2-methylpropyl)piperidine;4-(2-ethoxyethyl)-1-propylpiperidine;1-[3-(1-ethylazetidin-3-yl)oxypropyl]-4-(2-methylpropyl)piperazine;1-ethyl-4-[[1-(2-methylpropyl)azetidin-3-yl]methyl]piperazine;1-ethyl-4-[1-(2-methylpropyl)azetidin-3-yl]piperazine;4-[2-(2-methoxyethoxy)ethoxy]-1-propylpiperidine;4-(2-methoxyethoxy)-1-(2-methylpropyl)piperidine;4-(2-methoxyethyl)-1-propylpiperidine;1-[3-(1-methylazetidin-3-yl)oxypropyl]-4-(2-methylpropyl)piperazine;1-methyl-4-[[1-(2-methylpropyl)azetidin-3-yl]methyl]piperazine;1-methyl-4-[1-(2-methylpropyl)azetidin-3-yl]piperazine;1-methyl-4-[3-[1-(2-methylpropyl)piperidin-4-yl]propyl]piperazine |
| SMILES | CC(C)CN1CC(CN2CCN(C)CC2)C1.CC(C)CN1CC(N2CCN(C)CC2)C1.CC(C)CN1CCC(CCCN2CCN(C)CC2)CC1.CC(C)CN1CCN(CCCOC2CN(C)C2)CC1.CCCN1CCC(CCOC)CC1.CCCN1CCC(CCOCC)CC1.CCCN1CCC(OCCOCCOC)CC1.CCCN1CCC(OCCOCCOCC)CC1.CCN1CC(OCCCN2CCN(CC(C)C)CC2)C1.CCN1CCN(C2CN(CC(C)C)C2)CC1.CCN1CCN(CC2CN(CC(C)C)C2)CC1.CCOCCOC1CCN(CC(C)C)CC1.COCCOC1CCN(CC(C)C)CC1 |
| InChI | InChI=1S/C17H35N3.C16H33N3O.C15H31N3O.C14H29N3.C14H29NO3.2C13H27N3.C13H27NO3.C13H27NO2.C12H25N3.C12H25NO2.C12H25NO.C11H23NO/c1-16(2)15-20-9-6-17(7-10-20)5-4-8-19-13-11-18(3)12-14-19;1-4-17-13-16(14-17)20-11-5-6-18-7-9-19(10-8-18)12-15(2)3;1-14(2)11-18-8-6-17(7-9-18)5-4-10-19-15-12-16(3)13-15;1-4-15-5-7-16(8-6-15)10-14-11-17(12-14)9-13(2)3;1-3-7-15-8-5-14(6-9-15)18-13-12-17-11-10-16-4-2;1-12(2)8-16-10-13(11-16)9-15-6-4-14(3)5-7-15;1-4-14-5-7-16(8-6-14)13-10-15(11-13)9-12(2)3;1-3-6-14-7-4-13(5-8-14)17-12-11-16-10-9-15-2;1-4-15-9-10-16-13-5-7-14(8-6-13)11-12(2)3;1-11(2)8-14-9-12(10-14)15-6-4-13(3)5-7-15;1-11(2)10-13-6-4-12(5-7-13)15-9-8-14-3;1-3-8-13-9-5-12(6-10-13)7-11-14-4-2;1-3-7-12-8-4-11(5-9-12)6-10-13-2/h16-17H,4-15H2,1-3H3;15-16H,4-14H2,1-3H3;14-15H,4-13H2,1-3H3;13-14H,4-12H2,1-3H3;14H,3-13H2,1-2H3;2*12-13H,4-11H2,1-3H3;13H,3-12H2,1-2H3;12-13H,4-11H2,1-3H3;2*11-12H,4-10H2,1-3H3;12H,3-11H2,1-2H3;11H,3-10H2,1-2H3 |
| InChIKey | OFMYZCABDLRJMO-UHFFFAOYSA-N |
| XLogP | 20.39 |
| TPSA | 216.70 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 41 |
| Rotatable Bonds | 80 |
| Heavy Atoms | 216 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 3070.00 |
| LogP ≤ 5 | 20.39 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 41 |
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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