[1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate

C162H278O23 — CID 159935178

About [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate

[1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate (PubChem CID 159935178) has the molecular formula C162H278O23 and a molecular weight of 2593.98 g/mol. Its IUPAC name is [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate.

Molecular Properties

• Compound Name: [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate
• PubChem CID: 159935178
• Molecular Formula: C162H278O23
• Molecular Weight: 2593.98 g/mol
• Exact Mass: 2592.06
• IUPAC Name: [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate
• SMILES: C/C=C/C1(OC(=O)C(C)(C)CC)CCCCC1.C=C(C)C1(OC(=O)C(C)(C)CC)CCCC1.C=C(C)C1(OC(=O)C(C)(C)CC)CCCCC1.C=CC1(OC(=O)C(C)(C)CC)CCCC1.C=CC1(OC(=O)C(C)(C)CC)CCCCC1.C=CC1(OC(=O)C(C)(C)CC)CCCCCC1.C=CC1(OC(=O)C(C)(C)CC)CCCCCCC1.CCC(C)(C)C(=O)OC1(C=C(C)C)CCC(C)CC1.CCC(C)(C)C(=O)OC1(C=C2CCCC2)CCCCC1.CCOCC(C)(C)C1(OC(=O)CCOC(=O)C(C)(C)CC)C2CC3CC(C2)CC1C3
• InChI: InChI=1S/C25H42O5.C18H30O2.C17H30O2.C16H28O2.3C15H26O2.2C14H24O2.C13H22O2/c1-7-23(3,4)22(27)29-10-9-21(26)30-25(24(5,6)16-28-8-2)19-12-17-11-18(14-19)15-20(25)13-17;1-4-17(2,3)16(19)20-18(12-8-5-9-13-18)14-15-10-6-7-11-15;1-7-16(5,6)15(18)19-17(12-13(2)3)10-8-14(4)9-11-17;1-5-15(3,4)14(17)18-16(6-2)12-10-8-7-9-11-13-16;1-6-14(4,5)13(16)17-15(12(2)3)10-8-7-9-11-15;1-5-14(3,4)13(16)17-15(6-2)11-9-7-8-10-12-15;1-5-10-15(11-8-7-9-12-15)17-13(16)14(3,4)6-2;1-6-13(4,5)12(15)16-14(11(2)3)9-7-8-10-14;1-5-13(3,4)12(15)16-14(6-2)10-8-7-9-11-14;1-5-12(3,4)11(14)15-13(6-2)9-7-8-10-13/h17-20H,7-16H2,1-6H3;14H,4-13H2,1-3H3;12,14H,7-11H2,1-6H3;6H,2,5,7-13H2,1,3-4H3;2,6-11H2,1,3-5H3;6H,2,5,7-12H2,1,3-4H3;5,10H,6-9,11-12H2,1-4H3;2,6-10H2,1,3-5H3;6H,2,5,7-11H2,1,3-4H3;6H,2,5,7-10H2,1,3-4H3/b;;;;;;10-5+
• InChIKey: OADRPDYYWWRMDL-LLMZTKGYSA-N
• XLogP: 43.75
• TPSA: 298.53 Ų
• H-Bond Acceptors: 23
• Rotatable Bonds: 46
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2593.98
LogP ≤ 5	43.75
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate?

The IUPAC name of [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate (CID 159935178) is [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate.

What is the SMILES notation for [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate?

The canonical SMILES for [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate is C/C=C/C1(OC(=O)C(C)(C)CC)CCCCC1.C=C(C)C1(OC(=O)C(C)(C)CC)CCCC1.C=C(C)C1(OC(=O)C(C)(C)CC)CCCCC1.C=CC1(OC(=O)C(C)(C)CC)CCCC1.C=CC1(OC(=O)C(C)(C)CC)CCCCC1.C=CC1(OC(=O)C(C)(C)CC)CCCCCC1.C=CC1(OC(=O)C(C)(C)CC)CCCCCCC1.CCC(C)(C)C(=O)OC1(C=C(C)C)CCC(C)CC1.CCC(C)(C)C(=O)OC1(C=C2CCCC2)CCCCC1.CCOCC(C)(C)C1(OC(=O)CCOC(=O)C(C)(C)CC)C2CC3CC(C2)CC1C3.

What is the InChIKey of [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate?

The InChIKey is OADRPDYYWWRMDL-LLMZTKGYSA-N. The full InChI is InChI=1S/C25H42O5.C18H30O2.C17H30O2.C16H28O2.3C15H26O2.2C14H24O2.C13H22O2/c1-7-23(3,4)22(27)29-10-9-21(26)30-25(24(5,6)16-28-8-2)19-12-17-11-18(14-19)15-20(25)13-17;1-4-17(2,3)16(19)20-18(12-8-5-9-13-18)14-15-10-6-7-11-15;1-7-16(5,6)15(18)19-17(12-13(2)3)10-8-14(4)9-11-17;1-5-15(3,4)14(17)18-16(6-2)12-10-8-7-9-11-13-16;1-6-14(4,5)13(16)17-15(12(2)3)10-8-7-9-11-15;1-5-14(3,4)13(16)17-15(6-2)11-9-7-8-10-12-15;1-5-10-15(11-8-7-9-12-15)17-13(16)14(3,4)6-2;1-6-13(4,5)12(15)16-14(11(2)3)9-7-8-10-14;1-5-13(3,4)12(15)16-14(6-2)10-8-7-9-11-14;1-5-12(3,4)11(14)15-13(6-2)9-7-8-10-13/h17-20H,7-16H2,1-6H3;14H,4-13H2,1-3H3;12,14H,7-11H2,1-6H3;6H,2,5,7-13H2,1,3-4H3;2,6-11H2,1,3-5H3;6H,2,5,7-12H2,1,3-4H3;5,10H,6-9,11-12H2,1-4H3;2,6-10H2,1,3-5H3;6H,2,5,7-11H2,1,3-4H3;6H,2,5,7-10H2,1,3-4H3/b;;;;;;10-5+;;;.

What are the key properties of [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate?

[1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate has a molecular weight of 2593.98 g/mol, XLogP of 43.75, 46 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for [1-(cyclopentylidenemethyl)cyclohexyl] 2,2-dimethylbutanoate;(1-ethenylcycloheptyl) 2,2-dimethylbutanoate;(1-ethenylcyclohexyl) 2,2-dimethylbutanoate;(1-ethenylcyclooctyl) 2,2-dimethylbutanoate;(1-ethenylcyclopentyl) 2,2-dimethylbutanoate;[3-[[2-(1-ethoxy-2-methylpropan-2-yl)-2-adamantyl]oxy]-3-oxopropyl] 2,2-dimethylbutanoate;[4-methyl-1-(2-methylprop-1-enyl)cyclohexyl] 2,2-dimethylbutanoate;[1-[(E)-prop-1-enyl]cyclohexyl] 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclohexyl) 2,2-dimethylbutanoate;(1-prop-1-en-2-ylcyclopentyl) 2,2-dimethylbutanoate is sourced from PubChem (CID 159935178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).