2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate

C107H202N24O16 — CID 158340874

About 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate

2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate (PubChem CID 158340874) has the molecular formula C107H202N24O16 and a molecular weight of 2080.94 g/mol. Its IUPAC name is 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate.

Molecular Properties

• Compound Name: 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate
• PubChem CID: 158340874
• Molecular Formula: C107H202N24O16
• Molecular Weight: 2080.94 g/mol
• Exact Mass: 2079.57
• IUPAC Name: 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate
• SMILES: CN(C)CCOC(=O)CN1CCN(C2CCN(C)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCC(=O)N(C)C)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCC(=O)N3CCCCC3)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCCCN3CCOCC3)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCCN3CCCCC3)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCCN3CCOCC3)CC2)CC1
• InChI: InChI=1S/C19H36N4O3.C19H34N4O3.C19H36N4O2.C18H34N4O3.C16H30N4O3.C16H32N4O2/c1-20-6-3-18(4-7-20)23-10-8-22(9-11-23)17-19(24)26-14-2-5-21-12-15-25-16-13-21;1-20-9-5-17(6-10-20)22-13-11-21(12-14-22)15-19(25)26-16-18(24)23-7-3-2-4-8-23;1-20-9-5-18(6-10-20)23-13-11-22(12-14-23)17-19(24)25-16-15-21-7-3-2-4-8-21;1-19-4-2-17(3-5-19)22-8-6-21(7-9-22)16-18(23)25-15-12-20-10-13-24-14-11-20;1-17(2)15(21)13-23-16(22)12-19-8-10-20(11-9-19)14-4-6-18(3)7-5-14;1-17(2)12-13-22-16(21)14-19-8-10-20(11-9-19)15-4-6-18(3)7-5-15/h18H,2-17H2,1H3;17H,2-16H2,1H3;18H,2-17H2,1H3;17H,2-16H2,1H3;14H,4-13H2,1-3H3;15H,4-14H2,1-3H3
• InChIKey: GRDJWYVRVYSEQG-UHFFFAOYSA-N
• XLogP: -0.35
• TPSA: 288.16 Ų
• H-Bond Acceptors: 38
• Rotatable Bonds: 35
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2080.94
LogP ≤ 5	-0.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate?

The IUPAC name of 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate (CID 158340874) is 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate.

What is the SMILES notation for 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate?

The canonical SMILES for 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate is CN(C)CCOC(=O)CN1CCN(C2CCN(C)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCC(=O)N(C)C)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCC(=O)N3CCCCC3)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCCCN3CCOCC3)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCCN3CCCCC3)CC2)CC1.CN1CCC(N2CCN(CC(=O)OCCN3CCOCC3)CC2)CC1.

What is the InChIKey of 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate?

The InChIKey is GRDJWYVRVYSEQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H36N4O3.C19H34N4O3.C19H36N4O2.C18H34N4O3.C16H30N4O3.C16H32N4O2/c1-20-6-3-18(4-7-20)23-10-8-22(9-11-23)17-19(24)26-14-2-5-21-12-15-25-16-13-21;1-20-9-5-17(6-10-20)22-13-11-21(12-14-22)15-19(25)26-16-18(24)23-7-3-2-4-8-23;1-20-9-5-18(6-10-20)23-13-11-22(12-14-23)17-19(24)25-16-15-21-7-3-2-4-8-21;1-19-4-2-17(3-5-19)22-8-6-21(7-9-22)16-18(23)25-15-12-20-10-13-24-14-11-20;1-17(2)15(21)13-23-16(22)12-19-8-10-20(11-9-19)14-4-6-18(3)7-5-14;1-17(2)12-13-22-16(21)14-19-8-10-20(11-9-19)15-4-6-18(3)7-5-15/h18H,2-17H2,1H3;17H,2-16H2,1H3;18H,2-17H2,1H3;17H,2-16H2,1H3;14H,4-13H2,1-3H3;15H,4-14H2,1-3H3.

What are the key properties of 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate?

2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate has a molecular weight of 2080.94 g/mol, XLogP of -0.35, 35 rotatable bonds, 0 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(dimethylamino)ethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;[2-(dimethylamino)-2-oxoethyl] 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-morpholin-4-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;3-morpholin-4-ylpropyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;(2-oxo-2-piperidin-1-ylethyl) 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate;2-piperidin-1-ylethyl 2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]acetate is sourced from PubChem (CID 158340874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).