6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide

C112H136N24O6S5 — CID 157395285

IUPAC6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)Nc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.CN(C)c1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.Cc1cc(N)nc2sc(C(=O)NCCc3ccc(N4CCCCC4)cc3)c(N)c12.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)c(C)c3)sc2n1.Nc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1
InChIInChI=1S/C23H27N5O2S.C23H29N5OS.C23H28N4OS.C22H27N5OS.C21H25N5OS/c1-15(29)26-19-10-9-18-20(24)21(31-23(18)27-19)22(30)25-12-11-16-5-7-17(8-6-16)28-13-3-2-4-14-28;1-27(2)19-11-10-18-20(24)21(30-23(18)26-19)22(29)25-13-12-16-6-8-17(9-7-16)28-14-4-3-5-15-28;1-15-14-17(7-9-19(15)27-12-4-3-5-13-27)10-11-25-22(28)21-20(24)18-8-6-16(2)26-23(18)29-21;1-14-13-17(23)26-22-18(14)19(24)20(29-22)21(28)25-10-9-15-5-7-16(8-6-15)27-11-3-2-4-12-27;22-17-9-8-16-18(23)19(28-21(16)25-17)20(27)24-11-10-14-4-6-15(7-5-14)26-12-2-1-3-13-26/h5-10H,2-4,11-14,24H2,1H3,(H,25,30)(H,26,27,29);6-11H,3-5,12-15,24H2,1-2H3,(H,25,29);6-9,14H,3-5,10-13,24H2,1-2H3,(H,25,28);5-8,13H,2-4,9-12,24H2,1H3,(H2,23,26)(H,25,28);4-9H,1-3,10-13,23H2,(H2,22,25)(H,24,27)
InChIKeyBMMPLNFULRJAJH-UHFFFAOYSA-N
MW2074.82 g/mol
LogP19.32
Rot. Bonds27

About 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide

6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 157395285) has the molecular formula C112H136N24O6S5 and a molecular weight of 2074.82 g/mol. Its IUPAC name is 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide
PubChem CID157395285
Molecular FormulaC112H136N24O6S5
Molecular Weight2074.82 g/mol
Exact Mass2072.97
IUPAC Name6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)Nc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.CN(C)c1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.Cc1cc(N)nc2sc(C(=O)NCCc3ccc(N4CCCCC4)cc3)c(N)c12.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)c(C)c3)sc2n1.Nc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1
InChIInChI=1S/C23H27N5O2S.C23H29N5OS.C23H28N4OS.C22H27N5OS.C21H25N5OS/c1-15(29)26-19-10-9-18-20(24)21(31-23(18)27-19)22(30)25-12-11-16-5-7-17(8-6-16)28-13-3-2-4-14-28;1-27(2)19-11-10-18-20(24)21(30-23(18)26-19)22(29)25-13-12-16-6-8-17(9-7-16)28-14-4-3-5-15-28;1-15-14-17(7-9-19(15)27-12-4-3-5-13-27)10-11-25-22(28)21-20(24)18-8-6-16(2)26-23(18)29-21;1-14-13-17(23)26-22-18(14)19(24)20(29-22)21(28)25-10-9-15-5-7-16(8-6-15)27-11-3-2-4-12-27;22-17-9-8-16-18(23)19(28-21(16)25-17)20(27)24-11-10-14-4-6-15(7-5-14)26-12-2-1-3-13-26/h5-10H,2-4,11-14,24H2,1H3,(H,25,30)(H,26,27,29);6-11H,3-5,12-15,24H2,1-2H3,(H,25,29);6-9,14H,3-5,10-13,24H2,1-2H3,(H,25,28);5-8,13H,2-4,9-12,24H2,1H3,(H2,23,26)(H,25,28);4-9H,1-3,10-13,23H2,(H2,22,25)(H,24,27)
InChIKeyBMMPLNFULRJAJH-UHFFFAOYSA-N
XLogP19.32
TPSA440.63 Ų
H-Bond Donors13
H-Bond Acceptors29
Rotatable Bonds27
Heavy Atoms147
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002074.82
LogP ≤ 519.32
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

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

Analyze 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide (CID 157395285) is 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide is CC(=O)Nc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.CN(C)c1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.Cc1cc(N)nc2sc(C(=O)NCCc3ccc(N4CCCCC4)cc3)c(N)c12.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)c(C)c3)sc2n1.Nc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCCCC4)cc3)sc2n1.
What is the InChIKey of 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is BMMPLNFULRJAJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27N5O2S.C23H29N5OS.C23H28N4OS.C22H27N5OS.C21H25N5OS/c1-15(29)26-19-10-9-18-20(24)21(31-23(18)27-19)22(30)25-12-11-16-5-7-17(8-6-16)28-13-3-2-4-14-28;1-27(2)19-11-10-18-20(24)21(30-23(18)26-19)22(29)25-13-12-16-6-8-17(9-7-16)28-14-4-3-5-15-28;1-15-14-17(7-9-19(15)27-12-4-3-5-13-27)10-11-25-22(28)21-20(24)18-8-6-16(2)26-23(18)29-21;1-14-13-17(23)26-22-18(14)19(24)20(29-22)21(28)25-10-9-15-5-7-16(8-6-15)27-11-3-2-4-12-27;22-17-9-8-16-18(23)19(28-21(16)25-17)20(27)24-11-10-14-4-6-15(7-5-14)26-12-2-1-3-13-26/h5-10H,2-4,11-14,24H2,1H3,(H,25,30)(H,26,27,29);6-11H,3-5,12-15,24H2,1-2H3,(H,25,29);6-9,14H,3-5,10-13,24H2,1-2H3,(H,25,28);5-8,13H,2-4,9-12,24H2,1H3,(H2,23,26)(H,25,28);4-9H,1-3,10-13,23H2,(H2,22,25)(H,24,27).
What are the key properties of 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide?
6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 2074.82 g/mol, XLogP of 19.32, 27 rotatable bonds, 13 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 6-acetamido-3-amino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-(dimethylamino)-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-(3-methyl-4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-4-methyl-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide;3,6-diamino-N-[2-(4-piperidin-1-ylphenyl)ethyl]thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 157395285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).