(2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine

C85H100F2N26O4S5 — CID 163537263

About (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine

(2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine (PubChem CID 163537263) has the molecular formula C85H100F2N26O4S5 and a molecular weight of 1748.24 g/mol. Its IUPAC name is (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine.

Molecular Properties

• Compound Name: (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine
• PubChem CID: 163537263
• Molecular Formula: C85H100F2N26O4S5
• Molecular Weight: 1748.24 g/mol
• Exact Mass: 1746.70
• IUPAC Name: (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine
• SMILES: CC1(O)CCN(CCCNc2cc(N)nc3cc(-c4ccn[nH]4)sc23)CC1.CC1(O)CCN(CCNc2cc(N)nc3cc(-c4ccn[nH]4)sc23)CC1.CC[C@H](CO)Nc1cc(N)nc2cc(-c3ccn[nH]3)sc12.Nc1cc(CCC(F)(F)c2ccccn2)c2sc(-c3ccn[nH]3)cc2n1.Nc1cc(N[C@@H]2CCC[C@@H]2O)c2sc(C3=CC=NC3)cc2n1
• InChI: InChI=1S/C19H26N6OS.C18H15F2N5S.C18H24N6OS.C16H18N4OS.C14H17N5OS/c1-19(26)4-9-25(10-5-19)8-2-6-21-14-12-17(20)23-15-11-16(27-18(14)15)13-3-7-22-24-13;19-18(20,15-3-1-2-7-22-15)6-4-11-9-16(21)24-13-10-14(26-17(11)13)12-5-8-23-25-12;1-18(25)3-7-24(8-4-18)9-6-20-13-11-16(19)22-14-10-15(26-17(13)14)12-2-5-21-23-12;17-15-7-12(19-10-2-1-3-13(10)21)16-11(20-15)6-14(22-16)9-4-5-18-8-9;1-2-8(7-20)17-11-6-13(15)18-10-5-12(21-14(10)11)9-3-4-16-19-9/h3,7,11-12,26H,2,4-6,8-10H2,1H3,(H,22,24)(H3,20,21,23);1-3,5,7-10H,4,6H2,(H2,21,24)(H,23,25);2,5,10-11,25H,3-4,6-9H2,1H3,(H,21,23)(H3,19,20,22);4-7,10,13,21H,1-3,8H2,(H3,17,19,20);3-6,8,20H,2,7H2,1H3,(H,16,19)(H3,15,17,18)/t;;;10-,13+;8-/m...11/s1
• InChIKey: DYAUEDMYWBWJRX-IMZTWHKMSA-N
• XLogP: 14.96
• TPSA: 470.04 Ų
• H-Bond Donors: 17
• H-Bond Acceptors: 31
• Rotatable Bonds: 24
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1748.24
LogP ≤ 5	14.96
H-Bond Donors ≤ 5	17
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine?

The IUPAC name of (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine (CID 163537263) is (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine.

What is the SMILES notation for (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine?

The canonical SMILES for (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine is CC1(O)CCN(CCCNc2cc(N)nc3cc(-c4ccn[nH]4)sc23)CC1.CC1(O)CCN(CCNc2cc(N)nc3cc(-c4ccn[nH]4)sc23)CC1.CC[C@H](CO)Nc1cc(N)nc2cc(-c3ccn[nH]3)sc12.Nc1cc(CCC(F)(F)c2ccccn2)c2sc(-c3ccn[nH]3)cc2n1.Nc1cc(N[C@@H]2CCC[C@@H]2O)c2sc(C3=CC=NC3)cc2n1.

What is the InChIKey of (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine?

The InChIKey is DYAUEDMYWBWJRX-IMZTWHKMSA-N. The full InChI is InChI=1S/C19H26N6OS.C18H15F2N5S.C18H24N6OS.C16H18N4OS.C14H17N5OS/c1-19(26)4-9-25(10-5-19)8-2-6-21-14-12-17(20)23-15-11-16(27-18(14)15)13-3-7-22-24-13;19-18(20,15-3-1-2-7-22-15)6-4-11-9-16(21)24-13-10-14(26-17(11)13)12-5-8-23-25-12;1-18(25)3-7-24(8-4-18)9-6-20-13-11-16(19)22-14-10-15(26-17(13)14)12-2-5-21-23-12;17-15-7-12(19-10-2-1-3-13(10)21)16-11(20-15)6-14(22-16)9-4-5-18-8-9;1-2-8(7-20)17-11-6-13(15)18-10-5-12(21-14(10)11)9-3-4-16-19-9/h3,7,11-12,26H,2,4-6,8-10H2,1H3,(H,22,24)(H3,20,21,23);1-3,5,7-10H,4,6H2,(H2,21,24)(H,23,25);2,5,10-11,25H,3-4,6-9H2,1H3,(H,21,23)(H3,19,20,22);4-7,10,13,21H,1-3,8H2,(H3,17,19,20);3-6,8,20H,2,7H2,1H3,(H,16,19)(H3,15,17,18)/t;;;10-,13+;8-/m...11/s1.

What are the key properties of (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine?

(2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine has a molecular weight of 1748.24 g/mol, XLogP of 14.96, 24 rotatable bonds, 17 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for (2R)-2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]butan-1-ol;1-[2-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]ethyl]-4-methylpiperidin-4-ol;1-[3-[[5-amino-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-7-yl]amino]propyl]-4-methylpiperidin-4-ol;cis-(1S,2R)-2-[[5-amino-2-(2H-pyrrol-3-yl)thieno[3,2-b]pyridin-7-yl]amino]cyclopentan-1-ol;7-(3,3-difluoro-3-pyridin-2-ylpropyl)-2-(1H-pyrazol-5-yl)thieno[3,2-b]pyridin-5-amine is sourced from PubChem (CID 163537263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).