3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide

C113H128ClF4N21O19S5 — CID 163980638

About 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide

3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide (PubChem CID 163980638) has the molecular formula C113H128ClF4N21O19S5 and a molecular weight of 2356.17 g/mol. Its IUPAC name is 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide.

Molecular Properties

• Compound Name: 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide
• PubChem CID: 163980638
• Molecular Formula: C113H128ClF4N21O19S5
• Molecular Weight: 2356.17 g/mol
• Exact Mass: 2353.79
• IUPAC Name: 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide
• SMILES: CC(C)n1nc(-c2cccc(C3(C)CC3)c2)c2ncc(C(=O)NC3(C)CS(=O)(=O)C3)cc21.CC(C)n1nc(-c2cccc(OC(C)(F)F)c2)c2ncc(C(=O)NC3(C)CS(=O)(=O)C3)cc21.CC(F)Oc1ccc(Cl)c(-c2nn(C(C)C)c3cc(C(=O)NC4(C)CS(=O)(=O)C4)cnc23)c1.CCOc1cc(-c2nn(C(C)C)c3cc(C(=O)NC4(C)CS(=O)(=O)C4)cnc23)c(F)cn1.COC1(c2cccc(-c3nn(C(C)C)c4cc(C(=O)NC5(C)CS(=O)(=O)C5)cnc34)c2)CC1
• InChI: InChI=1S/C24H28N4O4S.C24H28N4O3S.C22H24ClFN4O4S.C22H24F2N4O4S.C21H24FN5O4S/c1-15(2)28-19-11-17(22(29)26-23(3)13-33(30,31)14-23)12-25-21(19)20(27-28)16-6-5-7-18(10-16)24(32-4)8-9-24;1-15(2)28-19-11-17(22(29)26-24(4)13-32(30,31)14-24)12-25-21(19)20(27-28)16-6-5-7-18(10-16)23(3)8-9-23;1-12(2)28-18-7-14(21(29)26-22(4)10-33(30,31)11-22)9-25-20(18)19(27-28)16-8-15(32-13(3)24)5-6-17(16)23;1-13(2)28-17-9-15(20(29)26-21(3)11-33(30,31)12-21)10-25-19(17)18(27-28)14-6-5-7-16(8-14)32-22(4,23)24;1-5-31-17-7-14(15(22)9-23-17)18-19-16(27(26-18)12(2)3)6-13(8-24-19)20(28)25-21(4)10-32(29,30)11-21/h5-7,10-12,15H,8-9,13-14H2,1-4H3,(H,26,29);5-7,10-12,15H,8-9,13-14H2,1-4H3,(H,26,29);5-9,12-13H,10-11H2,1-4H3,(H,26,29);5-10,13H,11-12H2,1-4H3,(H,26,29);6-9,12H,5,10-11H2,1-4H3,(H,25,28)
• InChIKey: SYBLPUQPIPIEFX-UHFFFAOYSA-N
• XLogP: 16.94
• TPSA: 519.56 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 35
• Rotatable Bonds: 29
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2356.17
LogP ≤ 5	16.94
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	35

Frequently Asked Questions

What is the IUPAC name of 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?

The IUPAC name of 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide (CID 163980638) is 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide.

What is the SMILES notation for 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?

The canonical SMILES for 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide is CC(C)n1nc(-c2cccc(C3(C)CC3)c2)c2ncc(C(=O)NC3(C)CS(=O)(=O)C3)cc21.CC(C)n1nc(-c2cccc(OC(C)(F)F)c2)c2ncc(C(=O)NC3(C)CS(=O)(=O)C3)cc21.CC(F)Oc1ccc(Cl)c(-c2nn(C(C)C)c3cc(C(=O)NC4(C)CS(=O)(=O)C4)cnc23)c1.CCOc1cc(-c2nn(C(C)C)c3cc(C(=O)NC4(C)CS(=O)(=O)C4)cnc23)c(F)cn1.COC1(c2cccc(-c3nn(C(C)C)c4cc(C(=O)NC5(C)CS(=O)(=O)C5)cnc34)c2)CC1.

What is the InChIKey of 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?

The InChIKey is SYBLPUQPIPIEFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O4S.C24H28N4O3S.C22H24ClFN4O4S.C22H24F2N4O4S.C21H24FN5O4S/c1-15(2)28-19-11-17(22(29)26-23(3)13-33(30,31)14-23)12-25-21(19)20(27-28)16-6-5-7-18(10-16)24(32-4)8-9-24;1-15(2)28-19-11-17(22(29)26-24(4)13-32(30,31)14-24)12-25-21(19)20(27-28)16-6-5-7-18(10-16)23(3)8-9-23;1-12(2)28-18-7-14(21(29)26-22(4)10-33(30,31)11-22)9-25-20(18)19(27-28)16-8-15(32-13(3)24)5-6-17(16)23;1-13(2)28-17-9-15(20(29)26-21(3)11-33(30,31)12-21)10-25-19(17)18(27-28)14-6-5-7-16(8-14)32-22(4,23)24;1-5-31-17-7-14(15(22)9-23-17)18-19-16(27(26-18)12(2)3)6-13(8-24-19)20(28)25-21(4)10-32(29,30)11-21/h5-7,10-12,15H,8-9,13-14H2,1-4H3,(H,26,29);5-7,10-12,15H,8-9,13-14H2,1-4H3,(H,26,29);5-9,12-13H,10-11H2,1-4H3,(H,26,29);5-10,13H,11-12H2,1-4H3,(H,26,29);6-9,12H,5,10-11H2,1-4H3,(H,25,28).

What are the key properties of 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?

3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide has a molecular weight of 2356.17 g/mol, XLogP of 16.94, 29 rotatable bonds, 5 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-chloro-5-(1-fluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1,1-difluoroethoxy)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-(2-ethoxy-5-fluoro-4-pyridinyl)-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methoxycyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-methylcyclopropyl)phenyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide is sourced from PubChem (CID 163980638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).