2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide

C118H115F5N20O8S6 — CID 158726302

About 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide

2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide (PubChem CID 158726302) has the molecular formula C118H115F5N20O8S6 and a molecular weight of 2228.74 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

• Compound Name: 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide
• PubChem CID: 158726302
• Molecular Formula: C118H115F5N20O8S6
• Molecular Weight: 2228.74 g/mol
• Exact Mass: 2226.75
• IUPAC Name: 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide
• SMILES: CCN1CCC(CCCOc2cccc(CC(=O)N(C)c3nc(-c4ccncc4)cs3)c2)CC1.CN1CCC(CCCOc2cccc(CC(=O)N(C)c3nc(-c4ccncc4)cs3)c2)CC1.O=C(CCc1ccc(F)cc1)Nc1cc(-c2ccncn2)cs1.O=C(Cc1ccc(F)cc1)Nc1cc(-c2ccncn2)cs1.O=C(Cc1ccc(F)cc1F)Nc1cc(-c2ccncn2)cs1.O=C(Cc1ccccc1F)Nc1cc(-c2ccncn2)cs1
• InChI: InChI=1S/C27H34N4O2S.C26H32N4O2S.C17H14FN3OS.C16H11F2N3OS.2C16H12FN3OS/c1-3-31-15-11-21(12-16-31)7-5-17-33-24-8-4-6-22(18-24)19-26(32)30(2)27-29-25(20-34-27)23-9-13-28-14-10-23;1-29-14-10-20(11-15-29)6-4-16-32-23-7-3-5-21(17-23)18-25(31)30(2)26-28-24(19-33-26)22-8-12-27-13-9-22;18-14-4-1-12(2-5-14)3-6-16(22)21-17-9-13(10-23-17)15-7-8-19-11-20-15;17-12-2-1-10(13(18)7-12)5-15(22)21-16-6-11(8-23-16)14-3-4-19-9-20-14;17-13-3-1-11(2-4-13)7-15(21)20-16-8-12(9-22-16)14-5-6-18-10-19-14;17-13-4-2-1-3-11(13)7-15(21)20-16-8-12(9-22-16)14-5-6-18-10-19-14/h4,6,8-10,13-14,18,20-21H,3,5,7,11-12,15-17,19H2,1-2H3;3,5,7-9,12-13,17,19-20H,4,6,10-11,14-16,18H2,1-2H3;1-2,4-5,7-11H,3,6H2,(H,21,22);1-4,6-9H,5H2,(H,21,22);2*1-6,8-10H,7H2,(H,20,21)
• InChIKey: IKNSRUOLEBPAFL-UHFFFAOYSA-N
• XLogP: 24.84
• TPSA: 336.64 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 28
• Rotatable Bonds: 36
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2228.74
LogP ≤ 5	24.84
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide?

The IUPAC name of 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide (CID 158726302) is 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide.

What is the SMILES notation for 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide?

The canonical SMILES for 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide is CCN1CCC(CCCOc2cccc(CC(=O)N(C)c3nc(-c4ccncc4)cs3)c2)CC1.CN1CCC(CCCOc2cccc(CC(=O)N(C)c3nc(-c4ccncc4)cs3)c2)CC1.O=C(CCc1ccc(F)cc1)Nc1cc(-c2ccncn2)cs1.O=C(Cc1ccc(F)cc1)Nc1cc(-c2ccncn2)cs1.O=C(Cc1ccc(F)cc1F)Nc1cc(-c2ccncn2)cs1.O=C(Cc1ccccc1F)Nc1cc(-c2ccncn2)cs1.

What is the InChIKey of 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide?

The InChIKey is IKNSRUOLEBPAFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H34N4O2S.C26H32N4O2S.C17H14FN3OS.C16H11F2N3OS.2C16H12FN3OS/c1-3-31-15-11-21(12-16-31)7-5-17-33-24-8-4-6-22(18-24)19-26(32)30(2)27-29-25(20-34-27)23-9-13-28-14-10-23;1-29-14-10-20(11-15-29)6-4-16-32-23-7-3-5-21(17-23)18-25(31)30(2)26-28-24(19-33-26)22-8-12-27-13-9-22;18-14-4-1-12(2-5-14)3-6-16(22)21-17-9-13(10-23-17)15-7-8-19-11-20-15;17-12-2-1-10(13(18)7-12)5-15(22)21-16-6-11(8-23-16)14-3-4-19-9-20-14;17-13-3-1-11(2-4-13)7-15(21)20-16-8-12(9-22-16)14-5-6-18-10-19-14;17-13-4-2-1-3-11(13)7-15(21)20-16-8-12(9-22-16)14-5-6-18-10-19-14/h4,6,8-10,13-14,18,20-21H,3,5,7,11-12,15-17,19H2,1-2H3;3,5,7-9,12-13,17,19-20H,4,6,10-11,14-16,18H2,1-2H3;1-2,4-5,7-11H,3,6H2,(H,21,22);1-4,6-9H,5H2,(H,21,22);2*1-6,8-10H,7H2,(H,20,21).

What are the key properties of 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide?

2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide has a molecular weight of 2228.74 g/mol, XLogP of 24.84, 36 rotatable bonds, 4 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,4-difluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-[3-[3-(1-ethylpiperidin-4-yl)propoxy]phenyl]-N-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-(2-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;2-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)acetamide;3-(4-fluorophenyl)-N-(4-pyrimidin-4-ylthiophen-2-yl)propanamide;N-methyl-2-[3-[3-(1-methylpiperidin-4-yl)propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 158726302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).