2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate

C67H107N11O28 — CID 158097010

About 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate

2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate (PubChem CID 158097010) has the molecular formula C67H107N11O28 and a molecular weight of 1514.64 g/mol. Its IUPAC name is 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate.

Molecular Properties

• Compound Name: 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate
• PubChem CID: 158097010
• Molecular Formula: C67H107N11O28
• Molecular Weight: 1514.64 g/mol
• Exact Mass: 1513.73
• IUPAC Name: 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate
• SMILES: CCCC(=O)CNC(=O)CCC(=O)CN(CC(=O)OC)C(=O)CCC(=O)CN.CCCC(=O)CNC(=O)CCC(=O)CN(CC(=O)OC)C(=O)CCC(=O)CNC(=O)OC(C)(C)C.CCCC(=O)CNC(=O)CN.COC(=O)CN(CC(=O)ON1C(=O)CCC1=O)C(=O)CCC(=O)CNC(=O)OC(C)(C)C
• InChI: InChI=1S/C23H37N3O9.C19H27N3O10.C18H29N3O7.C7H14N2O2/c1-6-7-16(27)12-24-19(30)10-8-18(29)14-26(15-21(32)34-5)20(31)11-9-17(28)13-25-22(33)35-23(2,3)4;1-19(2,3)31-18(29)20-9-12(23)5-6-13(24)21(10-16(27)30-4)11-17(28)32-22-14(25)7-8-15(22)26;1-3-4-14(23)10-20-16(25)7-5-15(24)11-21(12-18(27)28-2)17(26)8-6-13(22)9-19;1-2-3-6(10)5-9-7(11)4-8/h6-15H2,1-5H3,(H,24,30)(H,25,33);5-11H2,1-4H3,(H,20,29);3-12,19H2,1-2H3,(H,20,25);2-5,8H2,1H3,(H,9,11)
• InChIKey: FOUGTEPRZIWFSP-UHFFFAOYSA-N
• XLogP: -1.27
• TPSA: 556.07 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 30
• Rotatable Bonds: 46
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1514.64
LogP ≤ 5	-1.27
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate?

The IUPAC name of 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate (CID 158097010) is 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate.

What is the SMILES notation for 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate?

The canonical SMILES for 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate is CCCC(=O)CNC(=O)CCC(=O)CN(CC(=O)OC)C(=O)CCC(=O)CN.CCCC(=O)CNC(=O)CCC(=O)CN(CC(=O)OC)C(=O)CCC(=O)CNC(=O)OC(C)(C)C.CCCC(=O)CNC(=O)CN.COC(=O)CN(CC(=O)ON1C(=O)CCC1=O)C(=O)CCC(=O)CNC(=O)OC(C)(C)C.

What is the InChIKey of 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate?

The InChIKey is FOUGTEPRZIWFSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H37N3O9.C19H27N3O10.C18H29N3O7.C7H14N2O2/c1-6-7-16(27)12-24-19(30)10-8-18(29)14-26(15-21(32)34-5)20(31)11-9-17(28)13-25-22(33)35-23(2,3)4;1-19(2,3)31-18(29)20-9-12(23)5-6-13(24)21(10-16(27)30-4)11-17(28)32-22-14(25)7-8-15(22)26;1-3-4-14(23)10-20-16(25)7-5-15(24)11-21(12-18(27)28-2)17(26)8-6-13(22)9-19;1-2-3-6(10)5-9-7(11)4-8/h6-15H2,1-5H3,(H,24,30)(H,25,33);5-11H2,1-4H3,(H,20,29);3-12,19H2,1-2H3,(H,20,25);2-5,8H2,1H3,(H,9,11).

What are the key properties of 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate?

2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate has a molecular weight of 1514.64 g/mol, XLogP of -1.27, 46 rotatable bonds, 7 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-N-(2-oxopentyl)acetamide;methyl 2-[(5-amino-4-oxopentanoyl)-[2,5-dioxo-5-(2-oxopentylamino)pentyl]amino]acetate;methyl 2-[[2,5-dioxo-5-(2-oxopentylamino)pentyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate;methyl 2-[[2-(2,5-dioxopyrrolidin-1-yl)oxy-2-oxoethyl]-[5-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxopentanoyl]amino]acetate is sourced from PubChem (CID 158097010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).