2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione

C137H122FN29O11S8 — CID 160750365

About 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione

2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione (PubChem CID 160750365) has the molecular formula C137H122FN29O11S8 and a molecular weight of 2626.21 g/mol. Its IUPAC name is 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione.

Molecular Properties

• Compound Name: 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione
• PubChem CID: 160750365
• Molecular Formula: C137H122FN29O11S8
• Molecular Weight: 2626.21 g/mol
• Exact Mass: 2623.76
• IUPAC Name: 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione
• SMILES: CC(CC(=O)Nc1nc(-c2ccncc2)cs1)c1ccccc1.CC(Cc1ccccc1)C(=O)Nc1nc(-c2ccncc2)cs1.CNC(C(=O)Nc1nc(-c2ccncc2)cs1)c1ccccc1.COc1ccc(C(O)C(=O)Nc2nc(-c3ccncc3)cs2)cc1.NC(CC(=O)Nc1nc(-c2ccncc2)cs1)c1ccccc1.NC(Cc1cccc(F)c1)C(=O)Nc1nc(-c2ccncc2)cs1.Nc1ccc(CC(=O)Nc2nc(-c3ccncc3)cs2)cc1.O=C1NC(c2ccccc2)C(=O)N1c1nc(-c2ccncc2)cs1
• InChI: InChI=1S/2C18H17N3OS.C17H15FN4OS.C17H12N4O2S.2C17H16N4OS.C17H15N3O3S.C16H14N4OS/c1-13(14-5-3-2-4-6-14)11-17(22)21-18-20-16(12-23-18)15-7-9-19-10-8-15;1-13(11-14-5-3-2-4-6-14)17(22)21-18-20-16(12-23-18)15-7-9-19-10-8-15;18-13-3-1-2-11(8-13)9-14(19)16(23)22-17-21-15(10-24-17)12-4-6-20-7-5-12;22-15-14(12-4-2-1-3-5-12)20-16(23)21(15)17-19-13(10-24-17)11-6-8-18-9-7-11;1-18-15(13-5-3-2-4-6-13)16(22)21-17-20-14(11-23-17)12-7-9-19-10-8-12;18-14(12-4-2-1-3-5-12)10-16(22)21-17-20-15(11-23-17)13-6-8-19-9-7-13;1-23-13-4-2-12(3-5-13)15(21)16(22)20-17-19-14(10-24-17)11-6-8-18-9-7-11;17-13-3-1-11(2-4-13)9-15(21)20-16-19-14(10-22-16)12-5-7-18-8-6-12/h2*2-10,12-13H,11H2,1H3,(H,20,21,22);1-8,10,14H,9,19H2,(H,21,22,23);1-10,14H,(H,20,23);2-11,15,18H,1H3,(H,20,21,22);1-9,11,14H,10,18H2,(H,20,21,22);2-10,15,21H,1H3,(H,19,20,22);1-8,10H,9,17H2,(H,19,20,21)
• InChIKey: RWSSUABUJWZONC-UHFFFAOYSA-N
• XLogP: 26.41
• TPSA: 578.90 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 39
• Rotatable Bonds: 37
• Heavy Atoms: 186
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2626.21
LogP ≤ 5	26.41
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione?

The IUPAC name of 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione (CID 160750365) is 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione.

What is the SMILES notation for 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione?

The canonical SMILES for 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione is CC(CC(=O)Nc1nc(-c2ccncc2)cs1)c1ccccc1.CC(Cc1ccccc1)C(=O)Nc1nc(-c2ccncc2)cs1.CNC(C(=O)Nc1nc(-c2ccncc2)cs1)c1ccccc1.COc1ccc(C(O)C(=O)Nc2nc(-c3ccncc3)cs2)cc1.NC(CC(=O)Nc1nc(-c2ccncc2)cs1)c1ccccc1.NC(Cc1cccc(F)c1)C(=O)Nc1nc(-c2ccncc2)cs1.Nc1ccc(CC(=O)Nc2nc(-c3ccncc3)cs2)cc1.O=C1NC(c2ccccc2)C(=O)N1c1nc(-c2ccncc2)cs1.

What is the InChIKey of 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione?

The InChIKey is RWSSUABUJWZONC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H17N3OS.C17H15FN4OS.C17H12N4O2S.2C17H16N4OS.C17H15N3O3S.C16H14N4OS/c1-13(14-5-3-2-4-6-14)11-17(22)21-18-20-16(12-23-18)15-7-9-19-10-8-15;1-13(11-14-5-3-2-4-6-14)17(22)21-18-20-16(12-23-18)15-7-9-19-10-8-15;18-13-3-1-2-11(8-13)9-14(19)16(23)22-17-21-15(10-24-17)12-4-6-20-7-5-12;22-15-14(12-4-2-1-3-5-12)20-16(23)21(15)17-19-13(10-24-17)11-6-8-18-9-7-11;1-18-15(13-5-3-2-4-6-13)16(22)21-17-20-14(11-23-17)12-7-9-19-10-8-12;18-14(12-4-2-1-3-5-12)10-16(22)21-17-20-15(11-23-17)13-6-8-19-9-7-13;1-23-13-4-2-12(3-5-13)15(21)16(22)20-17-19-14(10-24-17)11-6-8-18-9-7-11;17-13-3-1-11(2-4-13)9-15(21)20-16-19-14(10-22-16)12-5-7-18-8-6-12/h2*2-10,12-13H,11H2,1H3,(H,20,21,22);1-8,10,14H,9,19H2,(H,21,22,23);1-10,14H,(H,20,23);2-11,15,18H,1H3,(H,20,21,22);1-9,11,14H,10,18H2,(H,20,21,22);2-10,15,21H,1H3,(H,19,20,22);1-8,10H,9,17H2,(H,19,20,21).

What are the key properties of 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione?

2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione has a molecular weight of 2626.21 g/mol, XLogP of 26.41, 37 rotatable bonds, 13 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-3-(3-fluorophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-(4-aminophenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;3-amino-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;2-hydroxy-2-(4-methoxyphenyl)-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(methylamino)-2-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-methyl-3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide;3-phenyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)butanamide;5-phenyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)imidazolidine-2,4-dione is sourced from PubChem (CID 160750365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).