N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone

C56H69N3O15 — CID 158815178

About N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone

N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone (PubChem CID 158815178) has the molecular formula C56H69N3O15 and a molecular weight of 1024.17 g/mol. Its IUPAC name is N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone.

Molecular Properties

• Compound Name: N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone
• PubChem CID: 158815178
• Molecular Formula: C56H69N3O15
• Molecular Weight: 1024.17 g/mol
• Exact Mass: 1023.47
• IUPAC Name: N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone
• SMILES: CCOc1c(OC)cc(-c2ccc(C(=O)C(OC)c3ccc(N4CCOCC4)cc3)o2)cc1OC.CCOc1c(OC)cc(-c2ccco2)cc1OC.COC(C(=O)N(C)OC)c1ccc(N2CCOCC2)cc1
• InChI: InChI=1S/C27H31NO7.C15H22N2O4.C14H16O4/c1-5-34-27-23(30-2)16-19(17-24(27)31-3)21-10-11-22(35-21)25(29)26(32-4)18-6-8-20(9-7-18)28-12-14-33-15-13-28;1-16(20-3)15(18)14(19-2)12-4-6-13(7-5-12)17-8-10-21-11-9-17;1-4-17-14-12(15-2)8-10(9-13(14)16-3)11-6-5-7-18-11/h6-11,16-17,26H,5,12-15H2,1-4H3;4-7,14H,8-11H2,1-3H3;5-9H,4H2,1-3H3
• InChIKey: IVEGXFDTWFAZPS-UHFFFAOYSA-N
• XLogP: 9.36
• TPSA: 171.67 Ų
• H-Bond Acceptors: 17
• Rotatable Bonds: 20
• Heavy Atoms: 74
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1024.17
LogP ≤ 5	9.36
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone?

The IUPAC name of N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone (CID 158815178) is N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone.

What is the SMILES notation for N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone?

The canonical SMILES for N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone is CCOc1c(OC)cc(-c2ccc(C(=O)C(OC)c3ccc(N4CCOCC4)cc3)o2)cc1OC.CCOc1c(OC)cc(-c2ccco2)cc1OC.COC(C(=O)N(C)OC)c1ccc(N2CCOCC2)cc1.

What is the InChIKey of N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone?

The InChIKey is IVEGXFDTWFAZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H31NO7.C15H22N2O4.C14H16O4/c1-5-34-27-23(30-2)16-19(17-24(27)31-3)21-10-11-22(35-21)25(29)26(32-4)18-6-8-20(9-7-18)28-12-14-33-15-13-28;1-16(20-3)15(18)14(19-2)12-4-6-13(7-5-12)17-8-10-21-11-9-17;1-4-17-14-12(15-2)8-10(9-13(14)16-3)11-6-5-7-18-11/h6-11,16-17,26H,5,12-15H2,1-4H3;4-7,14H,8-11H2,1-3H3;5-9H,4H2,1-3H3.

What are the key properties of N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone?

N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone has a molecular weight of 1024.17 g/mol, XLogP of 9.36, 20 rotatable bonds, 0 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for N,2-dimethoxy-N-methyl-2-(4-morpholin-4-ylphenyl)acetamide;2-(4-ethoxy-3,5-dimethoxyphenyl)furan;1-[5-(4-ethoxy-3,5-dimethoxyphenyl)furan-2-yl]-2-methoxy-2-(4-morpholin-4-ylphenyl)ethanone is sourced from PubChem (CID 158815178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).