About N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide
N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide (PubChem CID 163696759) has the molecular formula C138H162F12N26O21S
and a molecular weight of 2781.02 g/mol. Its IUPAC name is N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide.
Frequently Asked Questions
What is the IUPAC name of N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?
The IUPAC name of N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide (CID 163696759) is N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide.
What is the SMILES notation for N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?
The canonical SMILES for N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide is CC(F)Oc1ccc(F)c(-c2nn(C(C)C)c3cc(C(=O)NC(C)(C)CN(C)C)cnc23)c1.CC(F)Oc1cccc(-c2nn(C(C)C)c3cc(C(=O)NC(CO)C(F)(F)F)cnc23)c1.CC(F)Oc1cccc(-c2nn(C(C)C)c3cc(C(=O)NC4(CO)CC(F)(F)C4)cnc23)c1.CC(F)Oc1cccc(-c2nn(C(C)C)c3cc(C(=O)N[C@@]4([C@H](C)O)CCOC4)cnc23)c1.CC(F)Oc1cccc(-c2nn([C@@H]3COC[C@H]3O)c3cc(C(=O)NC4(C)CS(=O)(=O)C4)cnc23)c1.CC(F)Oc1cncc(-c2nn(C(C)C)c3cc(C(=O)N[C@@H](C(C)C)[C@H](C)O)cnc23)c1.
What is the InChIKey of N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?
The InChIKey is JXPOMNWQKNMBEU-LYKBDPFKSA-N. The full InChI is InChI=1S/C24H31F2N5O2.C24H29FN4O4.C23H25F3N4O3.C23H30FN5O3.C23H25FN4O6S.C21H22F4N4O3/c1-14(2)31-20-10-16(23(32)28-24(4,5)13-30(6)7)12-27-22(20)21(29-31)18-11-17(33-15(3)25)8-9-19(18)26;1-14(2)29-20-11-18(23(31)27-24(15(3)30)8-9-32-13-24)12-26-22(20)21(28-29)17-6-5-7-19(10-17)33-16(4)25;1-13(2)30-18-8-16(21(32)28-22(12-31)10-23(25,26)11-22)9-27-20(18)19(29-30)15-5-4-6-17(7-15)33-14(3)24;1-12(2)20(14(5)30)27-23(31)17-8-19-22(26-10-17)21(28-29(19)13(3)4)16-7-18(11-25-9-16)32-15(6)24;1-13(24)34-16-5-3-4-14(6-16)20-21-17(28(27-20)18-9-33-10-19(18)29)7-15(8-25-21)22(30)26-23(2)11-35(31,32)12-23;1-11(2)29-16-8-14(20(31)27-17(10-30)21(23,24)25)9-26-19(16)18(28-29)13-5-4-6-15(7-13)32-12(3)22/h8-12,14-15H,13H2,1-7H3,(H,28,32);5-7,10-12,14-16,30H,8-9,13H2,1-4H3,(H,27,31);4-9,13-14,31H,10-12H2,1-3H3,(H,28,32);7-15,20,30H,1-6H3,(H,27,31);3-8,13,18-19,29H,9-12H2,1-2H3,(H,26,30);4-9,11-12,17,30H,10H2,1-3H3,(H,27,31)/t;15-,16?,24-;;14-,15?,20-;13?,18-,19-;/m.0.01./s1.
What are the key properties of N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide?
N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide has a molecular weight of 2781.02 g/mol, XLogP of 22.06, 43 rotatable bonds, 11 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3,3-difluoro-1-(hydroxymethyl)cyclobutyl]-3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;N-[1-(dimethylamino)-2-methylpropan-2-yl]-3-[2-fluoro-5-(1-fluoroethoxy)phenyl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-N-[(3S)-3-[(1S)-1-hydroxyethyl]oxolan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-[(3R,4S)-4-hydroxyoxolan-3-yl]-N-(3-methyl-1,1-dioxothietan-3-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[3-(1-fluoroethoxy)phenyl]-1-propan-2-yl-N-(1,1,1-trifluoro-3-hydroxypropan-2-yl)pyrazolo[4,3-b]pyridine-6-carboxamide;3-[5-(1-fluoroethoxy)-3-pyridinyl]-N-[(2S,3S)-2-hydroxy-4-methylpentan-3-yl]-1-propan-2-ylpyrazolo[4,3-b]pyridine-6-carboxamide is sourced from PubChem (CID 163696759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).