[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate

C150H258O36 — CID 158037018

About [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate

[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate (PubChem CID 158037018) has the molecular formula C150H258O36 and a molecular weight of 2637.68 g/mol. Its IUPAC name is [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate.

Molecular Properties

• Compound Name: [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate
• PubChem CID: 158037018
• Molecular Formula: C150H258O36
• Molecular Weight: 2637.68 g/mol
• Exact Mass: 2635.84
• IUPAC Name: [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate
• SMILES: CCC(C)(C)C(=O)OC(C)(C)CCC(=O)OC1(C)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C)CC2CCC1C2.CCC(C)(C)C(=O)OCC(=O)OC1(C)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C)CCCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C2CCCCC2)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(CC)CC2CCC1C2.CCC(C)C(=O)OCC(=O)OC1(CC)CCCCC1.CCC1(OC(=O)C(C)(C)CCCOC(=O)C(C)(C)CC)CCCC1.CCC1(OC(=O)COC(=O)C(C)(C)CC)CCCCC1
• InChI: InChI=1S/C20H36O4.C19H32O4.C18H32O4.C17H28O4.C16H26O4.C16H28O4.2C15H26O4.C14H24O4/c1-7-18(3,4)16(21)23-15-11-12-19(5,6)17(22)24-20(8-2)13-9-10-14-20;1-4-18(2,3)17(21)22-14-16(20)23-19(12-8-9-13-19)15-10-6-5-7-11-15;1-7-16(2,3)15(20)22-17(4,5)13-10-14(19)21-18(6)11-8-9-12-18;1-5-16(3,4)15(19)20-11-14(18)21-17(6-2)10-12-7-8-13(17)9-12;1-5-15(2,3)14(18)19-10-13(17)20-16(4)9-11-6-7-12(16)8-11;1-5-15(3,4)14(18)19-12-13(17)20-16(6-2)10-8-7-9-11-16;1-5-14(2,3)13(17)18-11-12(16)19-15(4)9-7-6-8-10-15;1-4-12(3)14(17)18-11-13(16)19-15(5-2)9-7-6-8-10-15;1-5-13(2,3)12(16)17-10-11(15)18-14(4)8-6-7-9-14/h7-15H2,1-6H3;15H,4-14H2,1-3H3;7-13H2,1-6H3;12-13H,5-11H2,1-4H3;11-12H,5-10H2,1-4H3;5-12H2,1-4H3;5-11H2,1-4H3;12H,4-11H2,1-3H3;5-10H2,1-4H3
• InChIKey: FHWKLLMEMYMWRX-UHFFFAOYSA-N
• XLogP: 33.33
• TPSA: 473.40 Ų
• H-Bond Acceptors: 36
• Rotatable Bonds: 55
• Heavy Atoms: 186
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2637.68
LogP ≤ 5	33.33
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	36

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-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate?

The IUPAC name of [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate (CID 158037018) is [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate.

What is the SMILES notation for [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate?

The canonical SMILES for [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate is CCC(C)(C)C(=O)OC(C)(C)CCC(=O)OC1(C)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C)CC2CCC1C2.CCC(C)(C)C(=O)OCC(=O)OC1(C)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C)CCCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(C2CCCCC2)CCCC1.CCC(C)(C)C(=O)OCC(=O)OC1(CC)CC2CCC1C2.CCC(C)C(=O)OCC(=O)OC1(CC)CCCCC1.CCC1(OC(=O)C(C)(C)CCCOC(=O)C(C)(C)CC)CCCC1.CCC1(OC(=O)COC(=O)C(C)(C)CC)CCCCC1.

What is the InChIKey of [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate?

The InChIKey is FHWKLLMEMYMWRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36O4.C19H32O4.C18H32O4.C17H28O4.C16H26O4.C16H28O4.2C15H26O4.C14H24O4/c1-7-18(3,4)16(21)23-15-11-12-19(5,6)17(22)24-20(8-2)13-9-10-14-20;1-4-18(2,3)17(21)22-14-16(20)23-19(12-8-9-13-19)15-10-6-5-7-11-15;1-7-16(2,3)15(20)22-17(4,5)13-10-14(19)21-18(6)11-8-9-12-18;1-5-16(3,4)15(19)20-11-14(18)21-17(6-2)10-12-7-8-13(17)9-12;1-5-15(2,3)14(18)19-10-13(17)20-16(4)9-11-6-7-12(16)8-11;1-5-15(3,4)14(18)19-12-13(17)20-16(6-2)10-8-7-9-11-16;1-5-14(2,3)13(17)18-11-12(16)19-15(4)9-7-6-8-10-15;1-4-12(3)14(17)18-11-13(16)19-15(5-2)9-7-6-8-10-15;1-5-13(2,3)12(16)17-10-11(15)18-14(4)8-6-7-9-14/h7-15H2,1-6H3;15H,4-14H2,1-3H3;7-13H2,1-6H3;12-13H,5-11H2,1-4H3;11-12H,5-10H2,1-4H3;5-12H2,1-4H3;5-11H2,1-4H3;12H,4-11H2,1-3H3;5-10H2,1-4H3.

What are the key properties of [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate?

[2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate has a molecular weight of 2637.68 g/mol, XLogP of 33.33, 55 rotatable bonds, 0 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for [2-(1-cyclohexylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-[(2-ethyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-ethylcyclohexyl)oxy-2-oxoethyl] 2-methylbutanoate;(1-ethylcyclopentyl) 5-(2,2-dimethylbutanoyloxy)-2,2-dimethylpentanoate;[2-[(2-methyl-2-bicyclo[2.2.1]heptanyl)oxy]-2-oxoethyl] 2,2-dimethylbutanoate;[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate;(1-methylcyclopentyl) 4-(2,2-dimethylbutanoyloxy)-4-methylpentanoate;[2-(1-methylcyclopentyl)oxy-2-oxoethyl] 2,2-dimethylbutanoate is sourced from PubChem (CID 158037018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).