bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate

C161H281N11O22 — CID 158702284

About bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate

bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate (PubChem CID 158702284) has the molecular formula C161H281N11O22 and a molecular weight of 2723.07 g/mol. Its IUPAC name is bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate.

Molecular Properties

• Compound Name: bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate
• PubChem CID: 158702284
• Molecular Formula: C161H281N11O22
• Molecular Weight: 2723.07 g/mol
• Exact Mass: 2721.12
• IUPAC Name: bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate
• SMILES: CN1C(C)(C)CC(C(=O)OCC2CCC(C3CCC(COC(=O)C4CC(C)(C)N(C)C4(C)C)CC3)CC2)C1(C)C.CN1C(C)(C)CC(C(=O)OCC2CCC(COC(=O)C3CC(C)(C)N(C)C3(C)C)CC2)C1(C)C.CN1C(C)(C)CC(C(=O)OCc2ccc(COC(=O)C3CC(C)(C)N(C)C3(C)C)cc2)C1(C)C.CN1C(C)(C)CC(COC(=O)C2CCC(C3CCC(C(=O)OCC4CC(C)(C)N(C)C4(C)C)CC3)CC2)C1(C)C.CN1C(C)(C)CC(COC(=O)CC(CC(=O)OCC2CC(C)(C)N(C)C2(C)C)CC(=O)OCC2CC(C)(C)N(C)C2(C)C)C1(C)C
• InChI: InChI=1S/C37H67N3O6.2C34H60N2O4.C28H50N2O4.C28H44N2O4/c1-32(2)19-26(35(7,8)38(32)13)22-44-29(41)16-25(17-30(42)45-23-27-20-33(3,4)39(14)36(27,9)10)18-31(43)46-24-28-21-34(5,6)40(15)37(28,11)12;1-31(2)19-27(33(5,6)35(31)9)21-39-29(37)25-15-11-23(12-16-25)24-13-17-26(18-14-24)30(38)40-22-28-20-32(3,4)36(10)34(28,7)8;1-31(2)19-27(33(5,6)35(31)9)29(37)39-21-23-11-15-25(16-12-23)26-17-13-24(14-18-26)22-40-30(38)28-20-32(3,4)36(10)34(28,7)8;2*1-25(2)15-21(27(5,6)29(25)9)23(31)33-17-19-11-13-20(14-12-19)18-34-24(32)22-16-26(3,4)30(10)28(22,7)8/h25-28H,16-24H2,1-15H3;2*23-28H,11-22H2,1-10H3;19-22H,11-18H2,1-10H3;11-14,21-22H,15-18H2,1-10H3
• InChIKey: IHROOYZNKONTHO-UHFFFAOYSA-N
• XLogP: 29.02
• TPSA: 324.94 Ų
• H-Bond Acceptors: 33
• Rotatable Bonds: 38
• Heavy Atoms: 194
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2723.07
LogP ≤ 5	29.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	33

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate?

The IUPAC name of bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate (CID 158702284) is bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate.

What is the SMILES notation for bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate?

The canonical SMILES for bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate is CN1C(C)(C)CC(C(=O)OCC2CCC(C3CCC(COC(=O)C4CC(C)(C)N(C)C4(C)C)CC3)CC2)C1(C)C.CN1C(C)(C)CC(C(=O)OCC2CCC(COC(=O)C3CC(C)(C)N(C)C3(C)C)CC2)C1(C)C.CN1C(C)(C)CC(C(=O)OCc2ccc(COC(=O)C3CC(C)(C)N(C)C3(C)C)cc2)C1(C)C.CN1C(C)(C)CC(COC(=O)C2CCC(C3CCC(C(=O)OCC4CC(C)(C)N(C)C4(C)C)CC3)CC2)C1(C)C.CN1C(C)(C)CC(COC(=O)CC(CC(=O)OCC2CC(C)(C)N(C)C2(C)C)CC(=O)OCC2CC(C)(C)N(C)C2(C)C)C1(C)C.

What is the InChIKey of bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate?

The InChIKey is IHROOYZNKONTHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H67N3O6.2C34H60N2O4.C28H50N2O4.C28H44N2O4/c1-32(2)19-26(35(7,8)38(32)13)22-44-29(41)16-25(17-30(42)45-23-27-20-33(3,4)39(14)36(27,9)10)18-31(43)46-24-28-21-34(5,6)40(15)37(28,11)12;1-31(2)19-27(33(5,6)35(31)9)21-39-29(37)25-15-11-23(12-16-25)24-13-17-26(18-14-24)30(38)40-22-28-20-32(3,4)36(10)34(28,7)8;1-31(2)19-27(33(5,6)35(31)9)29(37)39-21-23-11-15-25(16-12-23)26-17-13-24(14-18-26)22-40-30(38)28-20-32(3,4)36(10)34(28,7)8;2*1-25(2)15-21(27(5,6)29(25)9)23(31)33-17-19-11-13-20(14-12-19)18-34-24(32)22-16-26(3,4)30(10)28(22,7)8/h25-28H,16-24H2,1-15H3;2*23-28H,11-22H2,1-10H3;19-22H,11-18H2,1-10H3;11-14,21-22H,15-18H2,1-10H3.

What are the key properties of bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate?

bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate has a molecular weight of 2723.07 g/mol, XLogP of 29.02, 38 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for bis[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl] 3-[2-oxo-2-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxy]ethyl]pentanedioate;[4-[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[(1,2,2,5,5-pentamethylpyrrolidine-3-carbonyl)oxymethyl]phenyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methyl 4-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxycarbonyl]cyclohexyl]cyclohexane-1-carboxylate is sourced from PubChem (CID 158702284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).