6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide

C135H146N36O9S — CID 162134307

About 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide

6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide (PubChem CID 162134307) has the molecular formula C135H146N36O9S and a molecular weight of 2448.96 g/mol. Its IUPAC name is 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide
• PubChem CID: 162134307
• Molecular Formula: C135H146N36O9S
• Molecular Weight: 2448.96 g/mol
• Exact Mass: 2447.18
• IUPAC Name: 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide
• SMILES: Cc1noc(C)c1-c1cccc(C(=O)Nc2cnccc2N2CCNCC2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(-c2cc[nH]c2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(-c2ccc(CN3CCOCC3)cc2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(-c2ccc(N3CCOCC3)nc2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(C2Cc3ccccc3N2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(S2=Cc3ccccc3C2)n1
• InChI: InChI=1S/C26H30N6O2.C24H27N7O2.C23H24N6O.C23H23N5OS.C20H22N6O2.C19H20N6O/c33-26(30-24-18-28-9-8-25(24)32-12-10-27-11-13-32)23-3-1-2-22(29-23)21-6-4-20(5-7-21)19-31-14-16-34-17-15-31;32-24(29-21-17-26-7-6-22(21)30-10-8-25-9-11-30)20-3-1-2-19(28-20)18-4-5-23(27-16-18)31-12-14-33-15-13-31;30-23(28-21-15-25-9-8-22(21)29-12-10-24-11-13-29)19-7-3-6-18(27-19)20-14-16-4-1-2-5-17(16)26-20;29-23(27-20-14-25-9-8-21(20)28-12-10-24-11-13-28)19-6-3-7-22(26-19)30-15-17-4-1-2-5-18(17)16-30;1-13-19(14(2)28-25-13)15-4-3-5-16(23-15)20(27)24-17-12-22-7-6-18(17)26-10-8-21-9-11-26;26-19(16-3-1-2-15(23-16)14-4-6-21-12-14)24-17-13-22-7-5-18(17)25-10-8-20-9-11-25/h1-9,18,27H,10-17,19H2,(H,30,33);1-7,16-17,25H,8-15H2,(H,29,32);1-9,15,20,24,26H,10-14H2,(H,28,30);1-9,14-15,24H,10-13,16H2,(H,27,29);3-7,12,21H,8-11H2,1-2H3,(H,24,27);1-7,12-13,20-21H,8-11H2,(H,24,26)
• InChIKey: ZJBJXYYGTHIQFA-UHFFFAOYSA-N
• XLogP: 15.20
• TPSA: 512.58 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 38
• Rotatable Bonds: 27
• Heavy Atoms: 181
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2448.96
LogP ≤ 5	15.20
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'thio_aldehyd_A(3)', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide?

The IUPAC name of 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide (CID 162134307) is 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide.

What is the SMILES notation for 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide?

The canonical SMILES for 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide is Cc1noc(C)c1-c1cccc(C(=O)Nc2cnccc2N2CCNCC2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(-c2cc[nH]c2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(-c2ccc(CN3CCOCC3)cc2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(-c2ccc(N3CCOCC3)nc2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(C2Cc3ccccc3N2)n1.O=C(Nc1cnccc1N1CCNCC1)c1cccc(S2=Cc3ccccc3C2)n1.

What is the InChIKey of 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide?

The InChIKey is ZJBJXYYGTHIQFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N6O2.C24H27N7O2.C23H24N6O.C23H23N5OS.C20H22N6O2.C19H20N6O/c33-26(30-24-18-28-9-8-25(24)32-12-10-27-11-13-32)23-3-1-2-22(29-23)21-6-4-20(5-7-21)19-31-14-16-34-17-15-31;32-24(29-21-17-26-7-6-22(21)30-10-8-25-9-11-30)20-3-1-2-19(28-20)18-4-5-23(27-16-18)31-12-14-33-15-13-31;30-23(28-21-15-25-9-8-22(21)29-12-10-24-11-13-29)19-7-3-6-18(27-19)20-14-16-4-1-2-5-17(16)26-20;29-23(27-20-14-25-9-8-21(20)28-12-10-24-11-13-28)19-6-3-7-22(26-19)30-15-17-4-1-2-5-18(17)16-30;1-13-19(14(2)28-25-13)15-4-3-5-16(23-15)20(27)24-17-12-22-7-6-18(17)26-10-8-21-9-11-26;26-19(16-3-1-2-15(23-16)14-4-6-21-12-14)24-17-13-22-7-5-18(17)25-10-8-20-9-11-25/h1-9,18,27H,10-17,19H2,(H,30,33);1-7,16-17,25H,8-15H2,(H,29,32);1-9,15,20,24,26H,10-14H2,(H,28,30);1-9,14-15,24H,10-13,16H2,(H,27,29);3-7,12,21H,8-11H2,1-2H3,(H,24,27);1-7,12-13,20-21H,8-11H2,(H,24,26).

What are the key properties of 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide?

6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide has a molecular weight of 2448.96 g/mol, XLogP of 15.20, 27 rotatable bonds, 14 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(1H-2-benzothiophen-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(2,3-dihydro-1H-indol-2-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-[4-(morpholin-4-ylmethyl)phenyl]-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;6-(6-morpholin-4-yl-3-pyridinyl)-N-(4-piperazin-1-yl-3-pyridinyl)pyridine-2-carboxamide;N-(4-piperazin-1-yl-3-pyridinyl)-6-(1H-pyrrol-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 162134307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).