N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide

C122H106N26O17S — CID 161256010

About N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide

N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide (PubChem CID 161256010) has the molecular formula C122H106N26O17S and a molecular weight of 2240.42 g/mol. Its IUPAC name is N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

• Compound Name: N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide
• PubChem CID: 161256010
• Molecular Formula: C122H106N26O17S
• Molecular Weight: 2240.42 g/mol
• Exact Mass: 2238.79
• IUPAC Name: N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide
• SMILES: C=CCOc1ccc(CC(C=O)NC(=O)c2cc(C)nn2-c2ccccn2)cc1.NC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cncn1-c1cc(-c2ncco2)ccn1.NC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cncn1-c1ccc(-c2ncco2)cn1.O=CC(Cc1ccccc1)NC(=O)c1cccc2[nH]c(-c3ccccc3)nc12.O=CC(Cc1ccccc1)NC(=O)c1cncn1-c1nc2ccccc2[nH]1.O=CC(Cc1ccccc1)NC(=O)c1cncs1
• InChI: InChI=1S/C23H19N3O2.2C22H18N6O4.C22H22N4O3.C20H17N5O2.C13H12N2O2S/c27-15-18(14-16-8-3-1-4-9-16)24-23(28)19-12-7-13-20-21(19)26-22(25-20)17-10-5-2-6-11-17;23-20(30)19(29)16(10-14-4-2-1-3-5-14)27-21(31)17-12-24-13-28(17)18-11-15(6-7-25-18)22-26-8-9-32-22;23-20(30)19(29)16(10-14-4-2-1-3-5-14)27-21(31)17-12-24-13-28(17)18-7-6-15(11-26-18)22-25-8-9-32-22;1-3-12-29-19-9-7-17(8-10-19)14-18(15-27)24-22(28)20-13-16(2)25-26(20)21-6-4-5-11-23-21;26-12-15(10-14-6-2-1-3-7-14)22-19(27)18-11-21-13-25(18)20-23-16-8-4-5-9-17(16)24-20;16-8-11(6-10-4-2-1-3-5-10)15-13(17)12-7-14-9-18-12/h1-13,15,18H,14H2,(H,24,28)(H,25,26);2*1-9,11-13,16H,10H2,(H2,23,30)(H,27,31);3-11,13,15,18H,1,12,14H2,2H3,(H,24,28);1-9,11-13,15H,10H2,(H,22,27)(H,23,24);1-5,7-9,11H,6H2,(H,15,17)
• InChIKey: VBXRCRWCMODYIS-UHFFFAOYSA-N
• XLogP: 13.06
• TPSA: 604.69 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 34
• Rotatable Bonds: 42
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2240.42
LogP ≤ 5	13.06
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide?

The IUPAC name of N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide (CID 161256010) is N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide.

What is the SMILES notation for N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide?

The canonical SMILES for N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide is C=CCOc1ccc(CC(C=O)NC(=O)c2cc(C)nn2-c2ccccn2)cc1.NC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cncn1-c1cc(-c2ncco2)ccn1.NC(=O)C(=O)C(Cc1ccccc1)NC(=O)c1cncn1-c1ccc(-c2ncco2)cn1.O=CC(Cc1ccccc1)NC(=O)c1cccc2[nH]c(-c3ccccc3)nc12.O=CC(Cc1ccccc1)NC(=O)c1cncn1-c1nc2ccccc2[nH]1.O=CC(Cc1ccccc1)NC(=O)c1cncs1.

What is the InChIKey of N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide?

The InChIKey is VBXRCRWCMODYIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19N3O2.2C22H18N6O4.C22H22N4O3.C20H17N5O2.C13H12N2O2S/c27-15-18(14-16-8-3-1-4-9-16)24-23(28)19-12-7-13-20-21(19)26-22(25-20)17-10-5-2-6-11-17;23-20(30)19(29)16(10-14-4-2-1-3-5-14)27-21(31)17-12-24-13-28(17)18-11-15(6-7-25-18)22-26-8-9-32-22;23-20(30)19(29)16(10-14-4-2-1-3-5-14)27-21(31)17-12-24-13-28(17)18-7-6-15(11-26-18)22-25-8-9-32-22;1-3-12-29-19-9-7-17(8-10-19)14-18(15-27)24-22(28)20-13-16(2)25-26(20)21-6-4-5-11-23-21;26-12-15(10-14-6-2-1-3-7-14)22-19(27)18-11-21-13-25(18)20-23-16-8-4-5-9-17(16)24-20;16-8-11(6-10-4-2-1-3-5-10)15-13(17)12-7-14-9-18-12/h1-13,15,18H,14H2,(H,24,28)(H,25,26);2*1-9,11-13,16H,10H2,(H2,23,30)(H,27,31);3-11,13,15,18H,1,12,14H2,2H3,(H,24,28);1-9,11-13,15H,10H2,(H,22,27)(H,23,24);1-5,7-9,11H,6H2,(H,15,17).

What are the key properties of N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide?

N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 2240.42 g/mol, XLogP of 13.06, 42 rotatable bonds, 10 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[4-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-3-[5-(1,3-oxazol-2-yl)-2-pyridinyl]imidazole-4-carboxamide;3-(1H-benzimidazol-2-yl)-N-(1-oxo-3-phenylpropan-2-yl)imidazole-4-carboxamide;5-methyl-N-[1-oxo-3-(4-prop-2-enoxyphenyl)propan-2-yl]-2-pyridin-2-ylpyrazole-3-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-2-phenyl-1H-benzimidazole-4-carboxamide;N-(1-oxo-3-phenylpropan-2-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 161256010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).