N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide

C92H88F10N24O13S2 — CID 163641719

About N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide

N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide (PubChem CID 163641719) has the molecular formula C92H88F10N24O13S2 and a molecular weight of 1991.98 g/mol. Its IUPAC name is N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide.

Molecular Properties

• Compound Name: N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide
• PubChem CID: 163641719
• Molecular Formula: C92H88F10N24O13S2
• Molecular Weight: 1991.98 g/mol
• Exact Mass: 1990.62
• IUPAC Name: N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide
• SMILES: CC(CS(C)(=O)=O)NC(=O)c1cnc2c(-c3cccc(OC(C)F)c3)nn(-c3ncc(F)cn3)c2c1.CC(F)COc1cc(-c2nn(C(C)C)c3cc(C(=O)NC4(C)CS(=O)(=O)C4)cnc23)c(F)cn1.CC(F)Oc1cccc(-c2nn(-c3ncc(F)cn3)c3cc(C(=O)NC(C)(C)C(N)=O)cnc23)c1.CC(F)Oc1cccc(-c2nn(-c3ncc(F)cn3)c3cc(C(=O)NCC4CC(F)(F)C4)cnc23)c1
• InChI: InChI=1S/C24H20F4N6O2.C23H21F2N7O3.C23H22F2N6O4S.C22H25F2N5O4S/c1-13(25)36-18-4-2-3-15(5-18)20-21-19(34(33-20)23-31-11-17(26)12-32-23)6-16(10-29-21)22(35)30-9-14-7-24(27,28)8-14;1-12(24)35-16-6-4-5-13(7-16)18-19-17(32(31-18)22-28-10-15(25)11-29-22)8-14(9-27-19)20(33)30-23(2,3)21(26)34;1-13(12-36(3,33)34)29-22(32)16-8-19-21(26-9-16)20(15-5-4-6-18(7-15)35-14(2)24)30-31(19)23-27-10-17(25)11-28-23;1-12(2)29-17-5-14(21(30)27-22(4)10-34(31,32)11-22)7-26-20(17)19(28-29)15-6-18(25-8-16(15)24)33-9-13(3)23/h2-6,10-14H,7-9H2,1H3,(H,30,35);4-12H,1-3H3,(H2,26,34)(H,30,33);4-11,13-14H,12H2,1-3H3,(H,29,32);5-8,12-13H,9-11H2,1-4H3,(H,27,30)
• InChIKey: IEUWCHOCHQTJFG-UHFFFAOYSA-N
• XLogP: 12.93
• TPSA: 477.76 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 32
• Rotatable Bonds: 29
• Heavy Atoms: 141
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1991.98
LogP ≤ 5	12.93
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	32

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?

The IUPAC name of N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide (CID 163641719) is N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide.

What is the SMILES notation for N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?

The canonical SMILES for N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide is CC(CS(C)(=O)=O)NC(=O)c1cnc2c(-c3cccc(OC(C)F)c3)nn(-c3ncc(F)cn3)c2c1.CC(F)COc1cc(-c2nn(C(C)C)c3cc(C(=O)NC4(C)CS(=O)(=O)C4)cnc23)c(F)cn1.CC(F)Oc1cccc(-c2nn(-c3ncc(F)cn3)c3cc(C(=O)NC(C)(C)C(N)=O)cnc23)c1.CC(F)Oc1cccc(-c2nn(-c3ncc(F)cn3)c3cc(C(=O)NCC4CC(F)(F)C4)cnc23)c1.

What is the InChIKey of N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?

The InChIKey is IEUWCHOCHQTJFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20F4N6O2.C23H21F2N7O3.C23H22F2N6O4S.C22H25F2N5O4S/c1-13(25)36-18-4-2-3-15(5-18)20-21-19(34(33-20)23-31-11-17(26)12-32-23)6-16(10-29-21)22(35)30-9-14-7-24(27,28)8-14;1-12(24)35-16-6-4-5-13(7-16)18-19-17(32(31-18)22-28-10-15(25)11-29-22)8-14(9-27-19)20(33)30-23(2,3)21(26)34;1-13(12-36(3,33)34)29-22(32)16-8-19-21(26-9-16)20(15-5-4-6-18(7-15)35-14(2)24)30-31(19)23-27-10-17(25)11-28-23;1-12(2)29-17-5-14(21(30)27-22(4)10-34(31,32)11-22)7-26-20(17)19(28-29)15-6-18(25-8-16(15)24)33-9-13(3)23/h2-6,10-14H,7-9H2,1H3,(H,30,35);4-12H,1-3H3,(H2,26,34)(H,30,33);4-11,13-14H,12H2,1-3H3,(H,29,32);5-8,12-13H,9-11H2,1-4H3,(H,27,30).

What are the key properties of N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?

N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide has a molecular weight of 1991.98 g/mol, XLogP of 12.93, 29 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for N-(1-amino-2-methyl-1-oxopropan-2-yl)-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;N-[(3,3-difluorocyclobutyl)methyl]-3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-(5-fluoropyrimidin-2-yl)-N-(1-methylsulfonylpropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-fluoro-2-(2-fluoropropoxy)-4-pyridinyl]-N-(3-methyl-1,1-dioxothietan-3-yl)-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide is sourced from PubChem (CID 163641719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).