(1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate

C131H150N14O23 — CID 161175093

About (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate

(1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate (PubChem CID 161175093) has the molecular formula C131H150N14O23 and a molecular weight of 2288.72 g/mol. Its IUPAC name is (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate.

Molecular Properties

• Compound Name: (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate
• PubChem CID: 161175093
• Molecular Formula: C131H150N14O23
• Molecular Weight: 2288.72 g/mol
• Exact Mass: 2287.10
• IUPAC Name: (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate
• SMILES: CC(=O)C1(COC(=O)c2cncn2[C@H](C)c2ccccc2)CCC1.CC(=O)C1(COC(=O)c2cncn2[C@H](C)c2ccccc2)CCCC1.CC(=O)C1(COC(=O)c2cncn2[C@H](C)c2ccccc2)COC1.CC(=O)C1(OC(=O)c2cncn2[C@H](C)c2ccccc2)CCC1.CC(=O)C1(OC(=O)c2cncn2[C@H](C)c2ccccc2)CCCC1.CC(=O)C1(OC(=O)c2cncn2[C@H](C)c2ccccc2)CCCCC1.CC(=O)C1(OC(=O)c2cncn2[C@H](C)c2ccccc2)COC1
• InChI: InChI=1S/2C20H24N2O3.2C19H22N2O3.C18H20N2O4.C18H20N2O3.C17H18N2O4/c1-15(17-9-5-3-6-10-17)22-14-21-13-18(22)19(24)25-20(16(2)23)11-7-4-8-12-20;1-15(17-8-4-3-5-9-17)22-14-21-12-18(22)19(24)25-13-20(16(2)23)10-6-7-11-20;1-14(16-8-4-3-5-9-16)21-13-20-12-17(21)18(23)24-19(15(2)22)10-6-7-11-19;1-14(16-7-4-3-5-8-16)21-13-20-11-17(21)18(23)24-12-19(15(2)22)9-6-10-19;1-13(15-6-4-3-5-7-15)20-12-19-8-16(20)17(22)24-11-18(14(2)21)9-23-10-18;1-13(15-7-4-3-5-8-15)20-12-19-11-16(20)17(22)23-18(14(2)21)9-6-10-18;1-12(14-6-4-3-5-7-14)19-11-18-8-15(19)16(21)23-17(13(2)20)9-22-10-17/h3,5-6,9-10,13-15H,4,7-8,11-12H2,1-2H3;3-5,8-9,12,14-15H,6-7,10-11,13H2,1-2H3;3-5,8-9,12-14H,6-7,10-11H2,1-2H3;3-5,7-8,11,13-14H,6,9-10,12H2,1-2H3;3-8,12-13H,9-11H2,1-2H3;3-5,7-8,11-13H,6,9-10H2,1-2H3;3-8,11-12H,9-10H2,1-2H3/t2*15-;2*14-;2*13-;12-/m1111111/s1
• InChIKey: URRSHCXPMNXLLX-JHRTUYHZSA-N
• XLogP: 22.12
• TPSA: 446.79 Ų
• H-Bond Acceptors: 37
• Rotatable Bonds: 38
• Heavy Atoms: 168
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2288.72
LogP ≤ 5	22.12
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate?

The IUPAC name of (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate (CID 161175093) is (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate.

What is the SMILES notation for (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate?

The canonical SMILES for (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate is CC(=O)C1(COC(=O)c2cncn2[C@H](C)c2ccccc2)CCC1.CC(=O)C1(COC(=O)c2cncn2[C@H](C)c2ccccc2)CCCC1.CC(=O)C1(COC(=O)c2cncn2[C@H](C)c2ccccc2)COC1.CC(=O)C1(OC(=O)c2cncn2[C@H](C)c2ccccc2)CCC1.CC(=O)C1(OC(=O)c2cncn2[C@H](C)c2ccccc2)CCCC1.CC(=O)C1(OC(=O)c2cncn2[C@H](C)c2ccccc2)CCCCC1.CC(=O)C1(OC(=O)c2cncn2[C@H](C)c2ccccc2)COC1.

What is the InChIKey of (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate?

The InChIKey is URRSHCXPMNXLLX-JHRTUYHZSA-N. The full InChI is InChI=1S/2C20H24N2O3.2C19H22N2O3.C18H20N2O4.C18H20N2O3.C17H18N2O4/c1-15(17-9-5-3-6-10-17)22-14-21-13-18(22)19(24)25-20(16(2)23)11-7-4-8-12-20;1-15(17-8-4-3-5-9-17)22-14-21-12-18(22)19(24)25-13-20(16(2)23)10-6-7-11-20;1-14(16-8-4-3-5-9-16)21-13-20-12-17(21)18(23)24-19(15(2)22)10-6-7-11-19;1-14(16-7-4-3-5-8-16)21-13-20-11-17(21)18(23)24-12-19(15(2)22)9-6-10-19;1-13(15-6-4-3-5-7-15)20-12-19-8-16(20)17(22)24-11-18(14(2)21)9-23-10-18;1-13(15-7-4-3-5-8-15)20-12-19-11-16(20)17(22)23-18(14(2)21)9-6-10-18;1-12(14-6-4-3-5-7-14)19-11-18-8-15(19)16(21)23-17(13(2)20)9-22-10-17/h3,5-6,9-10,13-15H,4,7-8,11-12H2,1-2H3;3-5,8-9,12,14-15H,6-7,10-11,13H2,1-2H3;3-5,8-9,12-14H,6-7,10-11H2,1-2H3;3-5,7-8,11,13-14H,6,9-10,12H2,1-2H3;3-8,12-13H,9-11H2,1-2H3;3-5,7-8,11-13H,6,9-10H2,1-2H3;3-8,11-12H,9-10H2,1-2H3/t2*15-;2*14-;2*13-;12-/m1111111/s1.

What are the key properties of (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate?

(1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate has a molecular weight of 2288.72 g/mol, XLogP of 22.12, 38 rotatable bonds, 0 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for (1-acetylcyclobutyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclobutyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclohexyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(1-acetylcyclopentyl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl)methyl 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate;(3-acetyloxetan-3-yl) 3-[(1R)-1-phenylethyl]imidazole-4-carboxylate is sourced from PubChem (CID 161175093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).