2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide

C172H134N48O12S9 — CID 159932165

About 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide

2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide (PubChem CID 159932165) has the molecular formula C172H134N48O12S9 and a molecular weight of 3353.89 g/mol. Its IUPAC name is 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide.

Molecular Properties

• Compound Name: 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide
• PubChem CID: 159932165
• Molecular Formula: C172H134N48O12S9
• Molecular Weight: 3353.89 g/mol
• Exact Mass: 3350.88
• IUPAC Name: 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide
• SMILES: C#Cc1ccc(COCC(=O)Nc2nc(-c3ccccn3)nc3sccc23)cc1.CC(C(=O)Nc1nc(-c2ccccn2)nc2sccc12)c1ccc(C#N)cc1.CC(C)(C(=O)Nc1nc(-c2ccccn2)nc2sccc12)c1ccc(C#N)cc1.O=C(CCC1=NCN=N1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(CCc1cncnc1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(CCn1ccnc1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(CCn1ccnc1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(COCc1ccccc1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(COCc1ccncc1)Nc1nc(-c2ccccn2)nc2sccc12
• InChI: InChI=1S/C22H17N5OS.C22H16N4O2S.C21H15N5OS.C20H16N4O2S.C19H15N5O2S.C18H14N6OS.2C17H14N6OS.C16H13N7OS/c1-22(2,15-8-6-14(13-23)7-9-15)21(28)27-18-16-10-12-29-20(16)26-19(25-18)17-5-3-4-11-24-17;1-2-15-6-8-16(9-7-15)13-28-14-19(27)24-20-17-10-12-29-22(17)26-21(25-20)18-5-3-4-11-23-18;1-13(15-7-5-14(12-22)6-8-15)20(27)25-18-16-9-11-28-21(16)26-19(24-18)17-4-2-3-10-23-17;25-17(13-26-12-14-6-2-1-3-7-14)22-18-15-9-11-27-20(15)24-19(23-18)16-8-4-5-10-21-16;25-16(12-26-11-13-4-8-20-9-5-13)22-17-14-6-10-27-19(14)24-18(23-17)15-3-1-2-7-21-15;25-15(5-4-12-9-19-11-20-10-12)22-16-13-6-8-26-18(13)24-17(23-16)14-3-1-2-7-21-14;2*24-14(4-8-23-9-7-18-11-23)20-15-12-5-10-25-17(12)22-16(21-15)13-3-1-2-6-19-13;24-13(5-4-12-18-9-19-23-12)20-14-10-6-8-25-16(10)22-15(21-14)11-3-1-2-7-17-11/h3-12H,1-2H3,(H,25,26,27,28);1,3-12H,13-14H2,(H,24,25,26,27);2-11,13H,1H3,(H,24,25,26,27);1-11H,12-13H2,(H,22,23,24,25);1-10H,11-12H2,(H,22,23,24,25);1-3,6-11H,4-5H2,(H,22,23,24,25);2*1-3,5-7,9-11H,4,8H2,(H,20,21,22,24);1-3,6-8H,4-5,9H2,(H,20,21,22,24)
• InChIKey: NZTXRWDUMUQQRR-UHFFFAOYSA-N
• XLogP: 32.38
• TPSA: 796.59 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 60
• Rotatable Bonds: 46
• Heavy Atoms: 241
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3353.89
LogP ≤ 5	32.38
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	60

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide?

The IUPAC name of 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide (CID 159932165) is 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide.

What is the SMILES notation for 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide?

The canonical SMILES for 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide is C#Cc1ccc(COCC(=O)Nc2nc(-c3ccccn3)nc3sccc23)cc1.CC(C(=O)Nc1nc(-c2ccccn2)nc2sccc12)c1ccc(C#N)cc1.CC(C)(C(=O)Nc1nc(-c2ccccn2)nc2sccc12)c1ccc(C#N)cc1.O=C(CCC1=NCN=N1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(CCc1cncnc1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(CCn1ccnc1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(CCn1ccnc1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(COCc1ccccc1)Nc1nc(-c2ccccn2)nc2sccc12.O=C(COCc1ccncc1)Nc1nc(-c2ccccn2)nc2sccc12.

What is the InChIKey of 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide?

The InChIKey is NZTXRWDUMUQQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N5OS.C22H16N4O2S.C21H15N5OS.C20H16N4O2S.C19H15N5O2S.C18H14N6OS.2C17H14N6OS.C16H13N7OS/c1-22(2,15-8-6-14(13-23)7-9-15)21(28)27-18-16-10-12-29-20(16)26-19(25-18)17-5-3-4-11-24-17;1-2-15-6-8-16(9-7-15)13-28-14-19(27)24-20-17-10-12-29-22(17)26-21(25-20)18-5-3-4-11-23-18;1-13(15-7-5-14(12-22)6-8-15)20(27)25-18-16-9-11-28-21(16)26-19(24-18)17-4-2-3-10-23-17;25-17(13-26-12-14-6-2-1-3-7-14)22-18-15-9-11-27-20(15)24-19(23-18)16-8-4-5-10-21-16;25-16(12-26-11-13-4-8-20-9-5-13)22-17-14-6-10-27-19(14)24-18(23-17)15-3-1-2-7-21-15;25-15(5-4-12-9-19-11-20-10-12)22-16-13-6-8-26-18(13)24-17(23-16)14-3-1-2-7-21-14;2*24-14(4-8-23-9-7-18-11-23)20-15-12-5-10-25-17(12)22-16(21-15)13-3-1-2-6-19-13;24-13(5-4-12-18-9-19-23-12)20-14-10-6-8-25-16(10)22-15(21-14)11-3-1-2-7-17-11/h3-12H,1-2H3,(H,25,26,27,28);1,3-12H,13-14H2,(H,24,25,26,27);2-11,13H,1H3,(H,24,25,26,27);1-11H,12-13H2,(H,22,23,24,25);1-10H,11-12H2,(H,22,23,24,25);1-3,6-11H,4-5H2,(H,22,23,24,25);2*1-3,5-7,9-11H,4,8H2,(H,20,21,22,24);1-3,6-8H,4-5,9H2,(H,20,21,22,24).

What are the key properties of 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide?

2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide has a molecular weight of 3353.89 g/mol, XLogP of 32.38, 46 rotatable bonds, 9 hydrogen bond donors, and 60 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(4-cyanophenyl)-2-methyl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-(4-cyanophenyl)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide;2-[(4-ethynylphenyl)methoxy]-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;bis(3-imidazol-1-yl-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)propanamide);2-phenylmethoxy-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;2-(pyridin-4-ylmethoxy)-N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)acetamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-pyrimidin-5-ylpropanamide;N-(2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)-3-(3H-1,2,4-triazol-5-yl)propanamide is sourced from PubChem (CID 159932165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).