bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide

C141H163ClF6N26O8S6 — CID 158617152

About bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide

bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 158617152) has the molecular formula C141H163ClF6N26O8S6 and a molecular weight of 2691.87 g/mol. Its IUPAC name is bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
• PubChem CID: 158617152
• Molecular Formula: C141H163ClF6N26O8S6
• Molecular Weight: 2691.87 g/mol
• Exact Mass: 2689.11
• IUPAC Name: bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
• SMILES: CN[C@@H]1CN(c2cc(F)c(CCNC(=O)c3sc4nc(C)ccc4c3N)cc2F)C[C@H]1F.CN[C@H]1CN(c2cc(F)c(CCNC(=O)c3sc4nc(C)ccc4c3N)cc2F)C[C@@H]1F.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCC5(CCCCC5)C4)cc3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCC5(CCCCC5)C4)cc3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(O[C@@H]4COC5(CCC5)C4)cc3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3cnc(N4CCCCC4)c(Cl)c3)sc2n1
• InChI: InChI=1S/2C26H32N4OS.C24H27N3O3S.2C22H24F3N5OS.C21H24ClN5OS/c2*1-18-5-10-21-22(27)23(32-25(21)29-18)24(31)28-15-11-19-6-8-20(9-7-19)30-16-14-26(17-30)12-3-2-4-13-26;1-15-3-8-19-20(25)21(31-23(19)27-15)22(28)26-12-9-16-4-6-17(7-5-16)30-18-13-24(29-14-18)10-2-11-24;2*1-11-3-4-13-19(26)20(32-22(13)29-11)21(31)28-6-5-12-7-15(24)18(8-14(12)23)30-9-16(25)17(10-30)27-2;1-13-5-6-15-17(23)18(29-21(15)26-13)20(28)24-8-7-14-11-16(22)19(25-12-14)27-9-3-2-4-10-27/h2*5-10H,2-4,11-17,27H2,1H3,(H,28,31);3-8,18H,2,9-14,25H2,1H3,(H,26,28);2*3-4,7-8,16-17,27H,5-6,9-10,26H2,1-2H3,(H,28,31);5-6,11-12H,2-4,7-10,23H2,1H3,(H,24,28)/t;;18-;2*16-,17-;/m..010./s1
• InChIKey: HXNMISMPEOSFGJ-YRIFAVDQSA-N
• XLogP: 25.46
• TPSA: 479.67 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 34
• Rotatable Bonds: 33
• Heavy Atoms: 188
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2691.87
LogP ≤ 5	25.46
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	34

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?

The IUPAC name of bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide (CID 158617152) is bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide.

What is the SMILES notation for bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?

The canonical SMILES for bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide is CN[C@@H]1CN(c2cc(F)c(CCNC(=O)c3sc4nc(C)ccc4c3N)cc2F)C[C@H]1F.CN[C@H]1CN(c2cc(F)c(CCNC(=O)c3sc4nc(C)ccc4c3N)cc2F)C[C@@H]1F.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCC5(CCCCC5)C4)cc3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(N4CCC5(CCCCC5)C4)cc3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(O[C@@H]4COC5(CCC5)C4)cc3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3cnc(N4CCCCC4)c(Cl)c3)sc2n1.

What is the InChIKey of bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?

The InChIKey is HXNMISMPEOSFGJ-YRIFAVDQSA-N. The full InChI is InChI=1S/2C26H32N4OS.C24H27N3O3S.2C22H24F3N5OS.C21H24ClN5OS/c2*1-18-5-10-21-22(27)23(32-25(21)29-18)24(31)28-15-11-19-6-8-20(9-7-19)30-16-14-26(17-30)12-3-2-4-13-26;1-15-3-8-19-20(25)21(31-23(19)27-15)22(28)26-12-9-16-4-6-17(7-5-16)30-18-13-24(29-14-18)10-2-11-24;2*1-11-3-4-13-19(26)20(32-22(13)29-11)21(31)28-6-5-12-7-15(24)18(8-14(12)23)30-9-16(25)17(10-30)27-2;1-13-5-6-15-17(23)18(29-21(15)26-13)20(28)24-8-7-14-11-16(22)19(25-12-14)27-9-3-2-4-10-27/h2*5-10H,2-4,11-17,27H2,1H3,(H,28,31);3-8,18H,2,9-14,25H2,1H3,(H,26,28);2*3-4,7-8,16-17,27H,5-6,9-10,26H2,1-2H3,(H,28,31);5-6,11-12H,2-4,7-10,23H2,1H3,(H,24,28)/t;;18-;2*16-,17-;/m..010./s1.

What are the key properties of bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?

bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 2691.87 g/mol, XLogP of 25.46, 33 rotatable bonds, 14 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for bis(3-amino-N-[2-[4-(2-azaspiro[4.5]decan-2-yl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(5-chloro-6-piperidin-1-yl-3-pyridinyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3S,4S)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[2,5-difluoro-4-[(3R,4R)-3-fluoro-4-(methylamino)pyrrolidin-1-yl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-[[(7S)-5-oxaspiro[3.4]octan-7-yl]oxy]phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 158617152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).