N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide

C137H123N33O20S2 — CID 158045384

About N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide

N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide (PubChem CID 158045384) has the molecular formula C137H123N33O20S2 and a molecular weight of 2615.84 g/mol. Its IUPAC name is N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide.

Molecular Properties

• Compound Name: N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide
• PubChem CID: 158045384
• Molecular Formula: C137H123N33O20S2
• Molecular Weight: 2615.84 g/mol
• Exact Mass: 2613.91
• IUPAC Name: N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide
• SMILES: Cc1cc(C(=O)NC(Cc2ccccc2)C(=O)C(=O)NC2CC2)n(-c2cnccn2)n1.Cc1cccc(-n2nc(C)cc2C(=O)NC(Cc2ccccc2)C(=O)C(N)=O)n1.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=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)c1scnc1-n1cc(-c2ccccc2)cn1.O=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)c1scnc1-n1ncc2ccccc21
• InChI: InChI=1S/C26H23N5O3S.C24H21N5O3S.2C22H18N6O4.C22H22N6O3.C21H21N5O3/c32-22(25(33)29-20-11-12-20)21(13-17-7-3-1-4-8-17)30-26(34)23-24(27-16-35-23)31-15-19(14-28-31)18-9-5-2-6-10-18;30-20(23(31)27-17-10-11-17)18(12-15-6-2-1-3-7-15)28-24(32)21-22(25-14-33-21)29-19-9-5-4-8-16(19)13-26-29;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;1-14-11-18(28(27-14)19-13-23-9-10-24-19)21(30)26-17(12-15-5-3-2-4-6-15)20(29)22(31)25-16-7-8-16;1-13-7-6-10-18(23-13)26-17(11-14(2)25-26)21(29)24-16(19(27)20(22)28)12-15-8-4-3-5-9-15/h1-10,14-16,20-21H,11-13H2,(H,29,33)(H,30,34);1-9,13-14,17-18H,10-12H2,(H,27,31)(H,28,32);2*1-9,11-13,16H,10H2,(H2,23,30)(H,27,31);2-6,9-11,13,16-17H,7-8,12H2,1H3,(H,25,31)(H,26,30);3-11,16H,12H2,1-2H3,(H2,22,28)(H,24,29)
• InChIKey: FIVOOPFQBJGSLW-UHFFFAOYSA-N
• XLogP: 10.93
• TPSA: 742.80 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 43
• Rotatable Bonds: 48
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2615.84
LogP ≤ 5	10.93
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	43

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide?

The IUPAC name of N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide (CID 158045384) is N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide.

What is the SMILES notation for N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide?

The canonical SMILES for N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide is Cc1cc(C(=O)NC(Cc2ccccc2)C(=O)C(=O)NC2CC2)n(-c2cnccn2)n1.Cc1cccc(-n2nc(C)cc2C(=O)NC(Cc2ccccc2)C(=O)C(N)=O)n1.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=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)c1scnc1-n1cc(-c2ccccc2)cn1.O=C(NC1CC1)C(=O)C(Cc1ccccc1)NC(=O)c1scnc1-n1ncc2ccccc21.

What is the InChIKey of N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide?

The InChIKey is FIVOOPFQBJGSLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23N5O3S.C24H21N5O3S.2C22H18N6O4.C22H22N6O3.C21H21N5O3/c32-22(25(33)29-20-11-12-20)21(13-17-7-3-1-4-8-17)30-26(34)23-24(27-16-35-23)31-15-19(14-28-31)18-9-5-2-6-10-18;30-20(23(31)27-17-10-11-17)18(12-15-6-2-1-3-7-15)28-24(32)21-22(25-14-33-21)29-19-9-5-4-8-16(19)13-26-29;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;1-14-11-18(28(27-14)19-13-23-9-10-24-19)21(30)26-17(12-15-5-3-2-4-6-15)20(29)22(31)25-16-7-8-16;1-13-7-6-10-18(23-13)26-17(11-14(2)25-26)21(29)24-16(19(27)20(22)28)12-15-8-4-3-5-9-15/h1-10,14-16,20-21H,11-13H2,(H,29,33)(H,30,34);1-9,13-14,17-18H,10-12H2,(H,27,31)(H,28,32);2*1-9,11-13,16H,10H2,(H2,23,30)(H,27,31);2-6,9-11,13,16-17H,7-8,12H2,1H3,(H,25,31)(H,26,30);3-11,16H,12H2,1-2H3,(H2,22,28)(H,24,29).

What are the key properties of N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide?

N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide has a molecular weight of 2615.84 g/mol, XLogP of 10.93, 48 rotatable bonds, 12 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-amino-3,4-dioxo-1-phenylbutan-2-yl)-5-methyl-2-(6-methyl-2-pyridinyl)pyrazole-3-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;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-indazol-1-yl-1,3-thiazole-5-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-5-methyl-2-pyrazin-2-ylpyrazole-3-carboxamide;N-[4-(cyclopropylamino)-3,4-dioxo-1-phenylbutan-2-yl]-4-(4-phenylpyrazol-1-yl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 158045384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).