3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide

C136H165F2N27O9S6 — CID 158202178

About 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide

3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide (PubChem CID 158202178) has the molecular formula C136H165F2N27O9S6 and a molecular weight of 2552.39 g/mol. Its IUPAC name is 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide
• PubChem CID: 158202178
• Molecular Formula: C136H165F2N27O9S6
• Molecular Weight: 2552.39 g/mol
• Exact Mass: 2550.16
• IUPAC Name: 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide
• SMILES: CC(C)Oc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.CCOc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.CNc1ccc2c(N)c(C(=O)NCCc3ccc(C4CCCCC4)cc3)sc2n1.CNc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.CNc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCN(C)CC4)cc3)sc2n1.Nc1c(C(=O)NCCc2ccc(N3CCCCC3)cc2)sc2nc(OC(F)F)ccc12
• InChI: InChI=1S/C24H30N4O2S.C23H28N4O2S.C23H28N4OS.C22H24F2N4O2S.C22H28N6OS.C22H27N5OS/c1-16(2)30-20-11-10-19-21(25)22(31-24(19)27-20)23(29)26-13-12-17-6-8-18(9-7-17)28-14-4-3-5-15-28;1-2-29-19-11-10-18-20(24)21(30-23(18)26-19)22(28)25-13-12-16-6-8-17(9-7-16)27-14-4-3-5-15-27;1-25-19-12-11-18-20(24)21(29-23(18)27-19)22(28)26-14-13-15-7-9-17(10-8-15)16-5-3-2-4-6-16;23-22(24)30-17-9-8-16-18(25)19(31-21(16)27-17)20(29)26-11-10-14-4-6-15(7-5-14)28-12-2-1-3-13-28;1-24-18-8-7-17-19(23)20(30-22(17)26-18)21(29)25-10-9-15-3-5-16(6-4-15)28-13-11-27(2)12-14-28;1-24-18-10-9-17-19(23)20(29-22(17)26-18)21(28)25-12-11-15-5-7-16(8-6-15)27-13-3-2-4-14-27/h6-11,16H,3-5,12-15,25H2,1-2H3,(H,26,29);6-11H,2-5,12-15,24H2,1H3,(H,25,28);7-12,16H,2-6,13-14,24H2,1H3,(H,25,27)(H,26,28);4-9,22H,1-3,10-13,25H2,(H,26,29);3-8H,9-14,23H2,1-2H3,(H,24,26)(H,25,29);5-10H,2-4,11-14,23H2,1H3,(H,24,26)(H,25,28)
• InChIKey: GBBNCVWXVVGIRZ-UHFFFAOYSA-N
• XLogP: 24.78
• TPSA: 491.28 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 36
• Rotatable Bonds: 39
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2552.39
LogP ≤ 5	24.78
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide?

The IUPAC name of 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide (CID 158202178) is 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide.

What is the SMILES notation for 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide?

The canonical SMILES for 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide is CC(C)Oc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.CCOc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.CNc1ccc2c(N)c(C(=O)NCCc3ccc(C4CCCCC4)cc3)sc2n1.CNc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.CNc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCN(C)CC4)cc3)sc2n1.Nc1c(C(=O)NCCc2ccc(N3CCCCC3)cc2)sc2nc(OC(F)F)ccc12.

What is the InChIKey of 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide?

The InChIKey is GBBNCVWXVVGIRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O2S.C23H28N4O2S.C23H28N4OS.C22H24F2N4O2S.C22H28N6OS.C22H27N5OS/c1-16(2)30-20-11-10-19-21(25)22(31-24(19)27-20)23(29)26-13-12-17-6-8-18(9-7-17)28-14-4-3-5-15-28;1-2-29-19-11-10-18-20(24)21(30-23(18)26-19)22(28)25-13-12-16-6-8-17(9-7-16)27-14-4-3-5-15-27;1-25-19-12-11-18-20(24)21(29-23(18)27-19)22(28)26-14-13-15-7-9-17(10-8-15)16-5-3-2-4-6-16;23-22(24)30-17-9-8-16-18(25)19(31-21(16)27-17)20(29)26-11-10-14-4-6-15(7-5-14)28-12-2-1-3-13-28;1-24-18-8-7-17-19(23)20(30-22(17)26-18)21(29)25-10-9-15-3-5-16(6-4-15)28-13-11-27(2)12-14-28;1-24-18-10-9-17-19(23)20(29-22(17)26-18)21(28)25-12-11-15-5-7-16(8-6-15)27-13-3-2-4-14-27/h6-11,16H,3-5,12-15,25H2,1-2H3,(H,26,29);6-11H,2-5,12-15,24H2,1H3,(H,25,28);7-12,16H,2-6,13-14,24H2,1H3,(H,25,27)(H,26,28);4-9,22H,1-3,10-13,25H2,(H,26,29);3-8H,9-14,23H2,1-2H3,(H,24,26)(H,25,29);5-10H,2-4,11-14,23H2,1H3,(H,24,26)(H,25,28).

What are the key properties of 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide?

3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 2552.39 g/mol, XLogP of 24.78, 39 rotatable bonds, 15 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 3-amino-N-[2-(4-cyclohexylphenyl)ethyl]-6-(methylamino)thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(difluoromethoxy)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-ethoxy-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(methylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]-6-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 158202178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).