N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide

C131H143FN18O9S6 — CID 158344714

About N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide

N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 158344714) has the molecular formula C131H143FN18O9S6 and a molecular weight of 2325.10 g/mol. Its IUPAC name is N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
• PubChem CID: 158344714
• Molecular Formula: C131H143FN18O9S6
• Molecular Weight: 2325.10 g/mol
• Exact Mass: 2322.96
• IUPAC Name: N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide
• SMILES: C=C(O)c1cccc(CCNC(=O)c2sc3nc(C)ccc3c2N)c1.CC(=O)Cc1ccc(CCNC(=O)c2sc3nc(C)ccc3c2N)cc1.CC(=O)c1ccc(CCNC(=O)c2sc3nc(C)ccc3c2N)cc1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(C4CCCCC4)cc3F)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(C4C[C@H]5CC[C@@H](C4)C5)cc3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(C4C[C@H]5CC[C@@H](C4)C5)cc3)sc2n1
• InChI: InChI=1S/2C25H29N3OS.C23H26FN3OS.C20H21N3O2S.2C19H19N3O2S/c2*1-15-2-9-21-22(26)23(30-25(21)28-15)24(29)27-11-10-16-5-7-19(8-6-16)20-13-17-3-4-18(12-17)14-20;1-14-7-10-18-20(25)21(29-23(18)27-14)22(28)26-12-11-16-8-9-17(13-19(16)24)15-5-3-2-4-6-15;1-12-3-8-16-17(21)18(26-20(16)23-12)19(25)22-10-9-14-4-6-15(7-5-14)11-13(2)24;1-11-3-8-15-16(20)17(25-19(15)22-11)18(24)21-10-9-13-4-6-14(7-5-13)12(2)23;1-11-6-7-15-16(20)17(25-19(15)22-11)18(24)21-9-8-13-4-3-5-14(10-13)12(2)23/h2*2,5-9,17-18,20H,3-4,10-14,26H2,1H3,(H,27,29);7-10,13,15H,2-6,11-12,25H2,1H3,(H,26,28);3-8H,9-11,21H2,1-2H3,(H,22,25);3-8H,9-10,20H2,1-2H3,(H,21,24);3-7,10,23H,2,8-9,20H2,1H3,(H,21,24)/t2*17-,18+,20?
• InChIKey: GROYBYUENXKHBY-GJUBELDASA-N
• XLogP: 26.59
• TPSA: 462.43 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 27
• Rotatable Bonds: 31
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2325.10
LogP ≤ 5	26.59
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?

The IUPAC name of N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide (CID 158344714) is N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide.

What is the SMILES notation for N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?

The canonical SMILES for N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide is C=C(O)c1cccc(CCNC(=O)c2sc3nc(C)ccc3c2N)c1.CC(=O)Cc1ccc(CCNC(=O)c2sc3nc(C)ccc3c2N)cc1.CC(=O)c1ccc(CCNC(=O)c2sc3nc(C)ccc3c2N)cc1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(C4CCCCC4)cc3F)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(C4C[C@H]5CC[C@@H](C4)C5)cc3)sc2n1.Cc1ccc2c(N)c(C(=O)NCCc3ccc(C4C[C@H]5CC[C@@H](C4)C5)cc3)sc2n1.

What is the InChIKey of N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?

The InChIKey is GROYBYUENXKHBY-GJUBELDASA-N. The full InChI is InChI=1S/2C25H29N3OS.C23H26FN3OS.C20H21N3O2S.2C19H19N3O2S/c2*1-15-2-9-21-22(26)23(30-25(21)28-15)24(29)27-11-10-16-5-7-19(8-6-16)20-13-17-3-4-18(12-17)14-20;1-14-7-10-18-20(25)21(29-23(18)27-14)22(28)26-12-11-16-8-9-17(13-19(16)24)15-5-3-2-4-6-15;1-12-3-8-16-17(21)18(26-20(16)23-12)19(25)22-10-9-14-4-6-15(7-5-14)11-13(2)24;1-11-3-8-15-16(20)17(25-19(15)22-11)18(24)21-10-9-13-4-6-14(7-5-13)12(2)23;1-11-6-7-15-16(20)17(25-19(15)22-11)18(24)21-9-8-13-4-3-5-14(10-13)12(2)23/h2*2,5-9,17-18,20H,3-4,10-14,26H2,1H3,(H,27,29);7-10,13,15H,2-6,11-12,25H2,1H3,(H,26,28);3-8H,9-11,21H2,1-2H3,(H,22,25);3-8H,9-10,20H2,1-2H3,(H,21,24);3-7,10,23H,2,8-9,20H2,1H3,(H,21,24)/t2*17-,18+,20?;;;;.

What are the key properties of N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide?

N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 2325.10 g/mol, XLogP of 26.59, 31 rotatable bonds, 13 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(4-acetylphenyl)ethyl]-3-amino-6-methylthieno[2,3-b]pyridine-2-carboxamide;bis(3-amino-N-[2-[4-[(1R,5S)-3-bicyclo[3.2.1]octanyl]phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide);3-amino-N-[2-(4-cyclohexyl-2-fluorophenyl)ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[2-[3-(1-hydroxyethenyl)phenyl]ethyl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-6-methyl-N-[2-[4-(2-oxopropyl)phenyl]ethyl]thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 158344714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).