[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate

C176H295N7O22 — CID 161161594

About [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate

[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate (PubChem CID 161161594) has the molecular formula C176H295N7O22 and a molecular weight of 2861.32 g/mol. Its IUPAC name is [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate.

Molecular Properties

• Compound Name: [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate
• PubChem CID: 161161594
• Molecular Formula: C176H295N7O22
• Molecular Weight: 2861.32 g/mol
• Exact Mass: 2859.22
• IUPAC Name: [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate
• SMILES: CC1CCC(CC(=O)C2CCC(COC(=O)C3CC(C)(C)N(C)C3(C)C)CC2)CC1.CC1CCC(CC(=O)C2CCC(COC(=O)C3CC(C)(C)NC3(C)C)CC2)CC1.CC1CCC(CC(=O)C2CCC(COCC3CC(C)(C)N(C)C3(C)C)CC2)CC1.CC1CCC(CC(=O)C2CCC(COCC3CC(C)(C)NC3(C)C)CC2)CC1.CC1CCC(OC(=O)C2CCC(COC(=O)C3CC(C)(C)N(C)C3(C)C)CC2)CC1.Cc1ccc(OC(=O)C2CCC(COC(=O)C3CC(C)(C)N(C)C3(C)C)CC2)cc1.Cc1ccc(OC(=O)C2CCC(COC(=O)C3CC(C)(C)NC3(C)C)CC2)cc1
• InChI: InChI=1S/C26H45NO3.C26H47NO2.C25H43NO4.C25H37NO4.C25H43NO3.C25H45NO2.C24H35NO4/c1-18-7-9-19(10-8-18)15-23(28)21-13-11-20(12-14-21)17-30-24(29)22-16-25(2,3)27(6)26(22,4)5;1-19-7-9-20(10-8-19)15-24(28)22-13-11-21(12-14-22)17-29-18-23-16-25(2,3)27(6)26(23,4)5;2*1-17-7-13-20(14-8-17)30-22(27)19-11-9-18(10-12-19)16-29-23(28)21-15-24(2,3)26(6)25(21,4)5;1-17-6-8-18(9-7-17)14-22(27)20-12-10-19(11-13-20)16-29-23(28)21-15-24(2,3)26-25(21,4)5;1-18-6-8-19(9-7-18)14-23(27)21-12-10-20(11-13-21)16-28-17-22-15-24(2,3)26-25(22,4)5;1-16-6-12-19(13-7-16)29-21(26)18-10-8-17(9-11-18)15-28-22(27)20-14-23(2,3)25-24(20,4)5/h18-22H,7-17H2,1-6H3;19-23H,7-18H2,1-6H3;17-21H,7-16H2,1-6H3;7-8,13-14,18-19,21H,9-12,15-16H2,1-6H3;17-21,26H,6-16H2,1-5H3;18-22,26H,6-17H2,1-5H3;6-7,12-13,17-18,20,25H,8-11,14-15H2,1-5H3
• InChIKey: UPZMEVFBNFTBLK-UHFFFAOYSA-N
• XLogP: 36.93
• TPSA: 346.19 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 29
• Rotatable Bonds: 41
• Heavy Atoms: 205
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2861.32
LogP ≤ 5	36.93
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate?

The IUPAC name of [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate (CID 161161594) is [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate.

What is the SMILES notation for [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate?

The canonical SMILES for [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate is CC1CCC(CC(=O)C2CCC(COC(=O)C3CC(C)(C)N(C)C3(C)C)CC2)CC1.CC1CCC(CC(=O)C2CCC(COC(=O)C3CC(C)(C)NC3(C)C)CC2)CC1.CC1CCC(CC(=O)C2CCC(COCC3CC(C)(C)N(C)C3(C)C)CC2)CC1.CC1CCC(CC(=O)C2CCC(COCC3CC(C)(C)NC3(C)C)CC2)CC1.CC1CCC(OC(=O)C2CCC(COC(=O)C3CC(C)(C)N(C)C3(C)C)CC2)CC1.Cc1ccc(OC(=O)C2CCC(COC(=O)C3CC(C)(C)N(C)C3(C)C)CC2)cc1.Cc1ccc(OC(=O)C2CCC(COC(=O)C3CC(C)(C)NC3(C)C)CC2)cc1.

What is the InChIKey of [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate?

The InChIKey is UPZMEVFBNFTBLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H45NO3.C26H47NO2.C25H43NO4.C25H37NO4.C25H43NO3.C25H45NO2.C24H35NO4/c1-18-7-9-19(10-8-18)15-23(28)21-13-11-20(12-14-21)17-30-24(29)22-16-25(2,3)27(6)26(22,4)5;1-19-7-9-20(10-8-19)15-24(28)22-13-11-21(12-14-22)17-29-18-23-16-25(2,3)27(6)26(23,4)5;2*1-17-7-13-20(14-8-17)30-22(27)19-11-9-18(10-12-19)16-29-23(28)21-15-24(2,3)26(6)25(21,4)5;1-17-6-8-18(9-7-17)14-22(27)20-12-10-19(11-13-20)16-29-23(28)21-15-24(2,3)26-25(21,4)5;1-18-6-8-19(9-7-18)14-23(27)21-12-10-20(11-13-21)16-28-17-22-15-24(2,3)26-25(22,4)5;1-16-6-12-19(13-7-16)29-21(26)18-10-8-17(9-11-18)15-28-22(27)20-14-23(2,3)25-24(20,4)5/h18-22H,7-17H2,1-6H3;19-23H,7-18H2,1-6H3;17-21H,7-16H2,1-6H3;7-8,13-14,18-19,21H,9-12,15-16H2,1-6H3;17-21,26H,6-16H2,1-5H3;18-22,26H,6-17H2,1-5H3;6-7,12-13,17-18,20,25H,8-11,14-15H2,1-5H3.

What are the key properties of [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate?

[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate has a molecular weight of 2861.32 g/mol, XLogP of 36.93, 41 rotatable bonds, 3 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for [4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-[2-(4-methylcyclohexyl)acetyl]cyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate;[4-(4-methylcyclohexyl)oxycarbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;2-(4-methylcyclohexyl)-1-[4-[(1,2,2,5,5-pentamethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;2-(4-methylcyclohexyl)-1-[4-[(2,2,5,5-tetramethylpyrrolidin-3-yl)methoxymethyl]cyclohexyl]ethanone;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 1,2,2,5,5-pentamethylpyrrolidine-3-carboxylate;[4-(4-methylphenoxy)carbonylcyclohexyl]methyl 2,2,5,5-tetramethylpyrrolidine-3-carboxylate is sourced from PubChem (CID 161161594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).