2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide

C135H153N25O14S6 — CID 161275162

About 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide

2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide (PubChem CID 161275162) has the molecular formula C135H153N25O14S6 and a molecular weight of 2542.27 g/mol. Its IUPAC name is 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide.

Molecular Properties

• Compound Name: 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide
• PubChem CID: 161275162
• Molecular Formula: C135H153N25O14S6
• Molecular Weight: 2542.27 g/mol
• Exact Mass: 2540.04
• IUPAC Name: 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide
• SMILES: CN(C)CCOc1cccc(CC(=O)Nc2nc(-c3ccncc3)cs2)c1.O=C(Cc1cccc(OCCCN2CCC(CO)CC2)c1)Nc1nc(-c2ccncc2)cs1.O=C(Cc1cccc(OCCCN2CCOCC2)c1)Nc1nc(-c2ccncc2)cs1.O=C(Cc1cccc(OCCN2CCCC2)c1)Nc1nc(-c2ccncc2)cs1.O=C(Cc1cccc(OCCN2CCCCC2)c1)Nc1nc(-c2ccncc2)cs1.O=C(Cc1cccc(OCCN2CCNCC2)c1)Nc1nc(-c2ccncc2)cs1
• InChI: InChI=1S/C25H30N4O3S.C23H26N4O3S.C23H26N4O2S.C22H25N5O2S.C22H24N4O2S.C20H22N4O2S/c30-17-19-7-12-29(13-8-19)11-2-14-32-22-4-1-3-20(15-22)16-24(31)28-25-27-23(18-33-25)21-5-9-26-10-6-21;28-22(26-23-25-21(17-31-23)19-5-7-24-8-6-19)16-18-3-1-4-20(15-18)30-12-2-9-27-10-13-29-14-11-27;28-22(26-23-25-21(17-30-23)19-7-9-24-10-8-19)16-18-5-4-6-20(15-18)29-14-13-27-11-2-1-3-12-27;28-21(26-22-25-20(16-30-22)18-4-6-23-7-5-18)15-17-2-1-3-19(14-17)29-13-12-27-10-8-24-9-11-27;27-21(25-22-24-20(16-29-22)18-6-8-23-9-7-18)15-17-4-3-5-19(14-17)28-13-12-26-10-1-2-11-26;1-24(2)10-11-26-17-5-3-4-15(12-17)13-19(25)23-20-22-18(14-27-20)16-6-8-21-9-7-16/h1,3-6,9-10,15,18-19,30H,2,7-8,11-14,16-17H2,(H,27,28,31);1,3-8,15,17H,2,9-14,16H2,(H,25,26,28);4-10,15,17H,1-3,11-14,16H2,(H,25,26,28);1-7,14,16,24H,8-13,15H2,(H,25,26,28);3-9,14,16H,1-2,10-13,15H2,(H,24,25,27);3-9,12,14H,10-11,13H2,1-2H3,(H,22,23,25)
• InChIKey: VEIOYTJABQWKMY-UHFFFAOYSA-N
• XLogP: 21.46
• TPSA: 445.59 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 39
• Rotatable Bonds: 51
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2542.27
LogP ≤ 5	21.46
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	39

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide?

The IUPAC name of 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide (CID 161275162) is 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide.

What is the SMILES notation for 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide?

The canonical SMILES for 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide is CN(C)CCOc1cccc(CC(=O)Nc2nc(-c3ccncc3)cs2)c1.O=C(Cc1cccc(OCCCN2CCC(CO)CC2)c1)Nc1nc(-c2ccncc2)cs1.O=C(Cc1cccc(OCCCN2CCOCC2)c1)Nc1nc(-c2ccncc2)cs1.O=C(Cc1cccc(OCCN2CCCC2)c1)Nc1nc(-c2ccncc2)cs1.O=C(Cc1cccc(OCCN2CCCCC2)c1)Nc1nc(-c2ccncc2)cs1.O=C(Cc1cccc(OCCN2CCNCC2)c1)Nc1nc(-c2ccncc2)cs1.

What is the InChIKey of 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide?

The InChIKey is VEIOYTJABQWKMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N4O3S.C23H26N4O3S.C23H26N4O2S.C22H25N5O2S.C22H24N4O2S.C20H22N4O2S/c30-17-19-7-12-29(13-8-19)11-2-14-32-22-4-1-3-20(15-22)16-24(31)28-25-27-23(18-33-25)21-5-9-26-10-6-21;28-22(26-23-25-21(17-31-23)19-5-7-24-8-6-19)16-18-3-1-4-20(15-18)30-12-2-9-27-10-13-29-14-11-27;28-22(26-23-25-21(17-30-23)19-7-9-24-10-8-19)16-18-5-4-6-20(15-18)29-14-13-27-11-2-1-3-12-27;28-21(26-22-25-20(16-30-22)18-4-6-23-7-5-18)15-17-2-1-3-19(14-17)29-13-12-27-10-8-24-9-11-27;27-21(25-22-24-20(16-29-22)18-6-8-23-9-7-18)15-17-4-3-5-19(14-17)28-13-12-26-10-1-2-11-26;1-24(2)10-11-26-17-5-3-4-15(12-17)13-19(25)23-20-22-18(14-27-20)16-6-8-21-9-7-16/h1,3-6,9-10,15,18-19,30H,2,7-8,11-14,16-17H2,(H,27,28,31);1,3-8,15,17H,2,9-14,16H2,(H,25,26,28);4-10,15,17H,1-3,11-14,16H2,(H,25,26,28);1-7,14,16,24H,8-13,15H2,(H,25,26,28);3-9,14,16H,1-2,10-13,15H2,(H,24,25,27);3-9,12,14H,10-11,13H2,1-2H3,(H,22,23,25).

What are the key properties of 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide?

2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide has a molecular weight of 2542.27 g/mol, XLogP of 21.46, 51 rotatable bonds, 8 hydrogen bond donors, and 39 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[2-(dimethylamino)ethoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-[3-[4-(hydroxymethyl)piperidin-1-yl]propoxy]phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(3-morpholin-4-ylpropoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperazin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;2-[3-(2-piperidin-1-ylethoxy)phenyl]-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)acetamide;N-(4-pyridin-4-yl-1,3-thiazol-2-yl)-2-[3-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide is sourced from PubChem (CID 161275162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).