N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide

C98H82F5N23O10 — CID 160502896

IUPACN-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide
SMILESCC(NC(=O)c1ccc2[nH]nc(/C=C/c3cccc(F)c3)c2n1)C(N)=O.NC(=O)C(CO)NC(=O)c1ccc2[nH]nc(/C=C/c3cccc(F)c3)c2n1.NC(=O)C(Cc1ccccc1)NC(=O)c1ccc2[nH]nc(/C=C/c3cccc(F)c3)c2n1.O=C(NC1CC1)c1cc2c(/C=C/c3cccc(F)c3)n[nH]c2cn1.O=C(NCc1ccco1)c1cc2c(/C=C/c3cccc(F)c3)n[nH]c2cn1
InChIInChI=1S/C24H20FN5O2.C20H15FN4O2.C18H16FN5O3.C18H16FN5O2.C18H15FN4O/c25-17-8-4-7-16(13-17)9-10-18-22-19(30-29-18)11-12-20(27-22)24(32)28-21(23(26)31)14-15-5-2-1-3-6-15;21-14-4-1-3-13(9-14)6-7-17-16-10-18(22-12-19(16)25-24-17)20(26)23-11-15-5-2-8-27-15;19-11-3-1-2-10(8-11)4-5-12-16-13(24-23-12)6-7-14(21-16)18(27)22-15(9-25)17(20)26;1-10(17(20)25)21-18(26)15-8-7-14-16(22-15)13(23-24-14)6-5-11-3-2-4-12(19)9-11;19-12-3-1-2-11(8-12)4-7-15-14-9-16(18(24)21-13-5-6-13)20-10-17(14)23-22-15/h1-13,21H,14H2,(H2,26,31)(H,28,32)(H,29,30);1-10,12H,11H2,(H,23,26)(H,24,25);1-8,15,25H,9H2,(H2,20,26)(H,22,27)(H,23,24);2-10H,1H3,(H2,20,25)(H,21,26)(H,23,24);1-4,7-10,13H,5-6H2,(H,21,24)(H,22,23)/b10-9+;7-6+;5-4+;6-5+;7-4+
InChIKeyQSABQLDJZBGUIK-KDSAUVOQSA-N
MW1836.87 g/mol
LogP12.76
Rot. Bonds27

About N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide

N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide (PubChem CID 160502896) has the molecular formula C98H82F5N23O10 and a molecular weight of 1836.87 g/mol. Its IUPAC name is N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide
PubChem CID160502896
Molecular FormulaC98H82F5N23O10
Molecular Weight1836.87 g/mol
Exact Mass1835.65
IUPAC NameN-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide
SMILESCC(NC(=O)c1ccc2[nH]nc(/C=C/c3cccc(F)c3)c2n1)C(N)=O.NC(=O)C(CO)NC(=O)c1ccc2[nH]nc(/C=C/c3cccc(F)c3)c2n1.NC(=O)C(Cc1ccccc1)NC(=O)c1ccc2[nH]nc(/C=C/c3cccc(F)c3)c2n1.O=C(NC1CC1)c1cc2c(/C=C/c3cccc(F)c3)n[nH]c2cn1.O=C(NCc1ccco1)c1cc2c(/C=C/c3cccc(F)c3)n[nH]c2cn1
InChIInChI=1S/C24H20FN5O2.C20H15FN4O2.C18H16FN5O3.C18H16FN5O2.C18H15FN4O/c25-17-8-4-7-16(13-17)9-10-18-22-19(30-29-18)11-12-20(27-22)24(32)28-21(23(26)31)14-15-5-2-1-3-6-15;21-14-4-1-3-13(9-14)6-7-17-16-10-18(22-12-19(16)25-24-17)20(26)23-11-15-5-2-8-27-15;19-11-3-1-2-10(8-11)4-5-12-16-13(24-23-12)6-7-14(21-16)18(27)22-15(9-25)17(20)26;1-10(17(20)25)21-18(26)15-8-7-14-16(22-15)13(23-24-14)6-5-11-3-2-4-12(19)9-11;19-12-3-1-2-11(8-12)4-7-15-14-9-16(18(24)21-13-5-6-13)20-10-17(14)23-22-15/h1-13,21H,14H2,(H2,26,31)(H,28,32)(H,29,30);1-10,12H,11H2,(H,23,26)(H,24,25);1-8,15,25H,9H2,(H2,20,26)(H,22,27)(H,23,24);2-10H,1H3,(H2,20,25)(H,21,26)(H,23,24);1-4,7-10,13H,5-6H2,(H,21,24)(H,22,23)/b10-9+;7-6+;5-4+;6-5+;7-4+
InChIKeyQSABQLDJZBGUIK-KDSAUVOQSA-N
XLogP12.76
TPSA515.99 Ų
H-Bond Donors14
H-Bond Acceptors20
Rotatable Bonds27
Heavy Atoms136
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001836.87
LogP ≤ 512.76
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1020

Analyze N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide with MolForge

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Related Compounds

5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157061672
5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-[(dimethylamino)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-(5-phenoxy-3-pyridinyl)-N-[6-(pyrrolidine-1-carbonyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 157075936
5-(5-amino-3-pyridinyl)-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-methylphenoxy)-3-pyridinyl]-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 157210321
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;methane
CID 157230427
5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-[6-(3-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(dimethylamino)methyl]-3-pyridinyl]-N-[6-(3-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-[6-(3-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-(5-morpholin-4-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157391943
5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157572346
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(2-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-[5-(oxan-4-ylamino)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 157601319
formic acid;6-(furan-2-yl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;6-(furan-3-yl)-N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-(5-methyl-3-pyridinyl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-(1H-pyrazol-5-yl)pyridine-2-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 157611001
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-(6-methyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(2-fluorophenoxy)-3-pyridinyl]-5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide;N-(6-methyl-3-pyridinyl)-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 157631176
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(4-methylphenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide;methane;N-[6-(4-methylphenoxy)-3-pyridinyl]-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 157632932
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-ethylpentanoyl)-3-pyridinyl]-1H-indazole-3-carboxamide;5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-N-[6-(3-ethylpentanoyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-ethylpentanoyl)-3-pyridinyl]-5-(5-pyrrolidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-[(4-hydroxypiperidin-1-yl)methyl]-3-pyridinyl]-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide;5-(5-phenoxy-3-pyridinyl)-N-[4-(trifluoromethyl)phenyl]-1H-indazole-3-carboxamide
CID 157738017
(E)-8-[4-[(E)-1-(1H-indazol-5-yl)-2-phenylbut-1-enyl]phenoxy]oct-3-en-2-one;(E)-N-methyl-7-[6-[(E)-4,4,4-trifluoro-1-(3-fluoro-2H-indazol-5-yl)but-1-enyl]pyridazin-3-yl]oxyhept-2-enamide;(E)-N-methyl-7-[5-[(Z)-4,4,4-trifluoro-1-(3-fluoro-2H-indazol-5-yl)-2-phenylbut-1-enyl]pyrazin-2-yl]oxyhept-2-enamide;N-methyl-7-[[5-[(Z)-4,4,4-trifluoro-1-(3-fluoro-2H-indazol-5-yl)-2-phenylbut-1-enyl]-2-pyridinyl]oxy]heptanamide;(E)-N-methyl-7-[[6-[(Z)-4,4,4-trifluoro-1-(3-fluoro-2H-indazol-5-yl)-2-phenylbut-1-enyl]-3-pyridinyl]oxy]hept-2-enamide;1-[2-[4-[(E)-4,4,4-trifluoro-1-(3-fluoro-2H-indazol-5-yl)-2-phenylbut-1-enyl]phenoxy]ethyl]pyrrolidin-2-one;(E)-8-[[5-[(Z)-4,4,4-trifluoro-1-(3-fluoro-2H-indazol-5-yl)-2-phenylbut-1-enyl]-2-pyridinyl]oxy]oct-3-en-2-one
CID 158067410

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide?
The IUPAC name of N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide (CID 160502896) is N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide.
What is the SMILES notation for N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide?
The canonical SMILES for N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide is CC(NC(=O)c1ccc2[nH]nc(/C=C/c3cccc(F)c3)c2n1)C(N)=O.NC(=O)C(CO)NC(=O)c1ccc2[nH]nc(/C=C/c3cccc(F)c3)c2n1.NC(=O)C(Cc1ccccc1)NC(=O)c1ccc2[nH]nc(/C=C/c3cccc(F)c3)c2n1.O=C(NC1CC1)c1cc2c(/C=C/c3cccc(F)c3)n[nH]c2cn1.O=C(NCc1ccco1)c1cc2c(/C=C/c3cccc(F)c3)n[nH]c2cn1.
What is the InChIKey of N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide?
The InChIKey is QSABQLDJZBGUIK-KDSAUVOQSA-N. The full InChI is InChI=1S/C24H20FN5O2.C20H15FN4O2.C18H16FN5O3.C18H16FN5O2.C18H15FN4O/c25-17-8-4-7-16(13-17)9-10-18-22-19(30-29-18)11-12-20(27-22)24(32)28-21(23(26)31)14-15-5-2-1-3-6-15;21-14-4-1-3-13(9-14)6-7-17-16-10-18(22-12-19(16)25-24-17)20(26)23-11-15-5-2-8-27-15;19-11-3-1-2-10(8-11)4-5-12-16-13(24-23-12)6-7-14(21-16)18(27)22-15(9-25)17(20)26;1-10(17(20)25)21-18(26)15-8-7-14-16(22-15)13(23-24-14)6-5-11-3-2-4-12(19)9-11;19-12-3-1-2-11(8-12)4-7-15-14-9-16(18(24)21-13-5-6-13)20-10-17(14)23-22-15/h1-13,21H,14H2,(H2,26,31)(H,28,32)(H,29,30);1-10,12H,11H2,(H,23,26)(H,24,25);1-8,15,25H,9H2,(H2,20,26)(H,22,27)(H,23,24);2-10H,1H3,(H2,20,25)(H,21,26)(H,23,24);1-4,7-10,13H,5-6H2,(H,21,24)(H,22,23)/b10-9+;7-6+;5-4+;6-5+;7-4+.
What are the key properties of N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide?
N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide has a molecular weight of 1836.87 g/mol, XLogP of 12.76, 27 rotatable bonds, 14 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-3-hydroxy-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxo-3-phenylpropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-(1-amino-1-oxopropan-2-yl)-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[4,3-b]pyridine-5-carboxamide;N-cyclopropyl-3-[(E)-2-(3-fluorophenyl)ethenyl]-1H-pyrazolo[3,4-c]pyridine-5-carboxamide;3-[(E)-2-(3-fluorophenyl)ethenyl]-N-(furan-2-ylmethyl)-1H-pyrazolo[3,4-c]pyridine-5-carboxamide is sourced from PubChem (CID 160502896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).