N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine

C133H127F3N30O7S3 — CID 161390712

IUPACN-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESC=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCC(F)(F)C1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCC(S(C)(=O)=O)C1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCCS(=O)(=O)CC1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCNCC1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CC[C@@H](F)C1.CS(=O)(=O)CCNC(=O)c1cccc2cc(Cc3[nH]nc4cccnc34)ccc12
InChIInChI=1S/2C23H23N5O2S.C22H19F2N5.C22H20FN5.C22H22N6.C21H20N4O3S/c1-15(28-12-10-18(14-28)31(2,29)30)19-6-3-5-16-13-17(8-9-20(16)19)25-23-22-21(26-27-23)7-4-11-24-22;1-16(28-11-4-13-31(29,30)14-12-28)19-6-2-5-17-15-18(8-9-20(17)19)25-23-22-21(26-27-23)7-3-10-24-22;1-14(29-11-9-22(23,24)13-29)17-5-2-4-15-12-16(7-8-18(15)17)26-21-20-19(27-28-21)6-3-10-25-20;1-14(28-11-9-16(23)13-28)18-5-2-4-15-12-17(7-8-19(15)18)25-22-21-20(26-27-22)6-3-10-24-21;1-15(28-12-10-23-11-13-28)18-5-2-4-16-14-17(7-8-19(16)18)25-22-21-20(26-27-22)6-3-9-24-21;1-29(27,28)11-10-23-21(26)17-5-2-4-15-12-14(7-8-16(15)17)13-19-20-18(24-25-19)6-3-9-22-20/h3-9,11,13,18H,1,10,12,14H2,2H3,(H2,25,26,27);2-3,5-10,15H,1,4,11-14H2,(H2,25,26,27);2-8,10,12H,1,9,11,13H2,(H2,26,27,28);2-8,10,12,16H,1,9,11,13H2,(H2,25,26,27);2-9,14,23H,1,10-13H2,(H2,25,26,27);2-9,12H,10-11,13H2,1H3,(H,23,26)(H,24,25)/t;;;16-;;/m...1../s1
InChIKeyVSYJOIXHEPHXMY-WWPSXCDTSA-N
MW2410.88 g/mol
LogP24.13
Rot. Bonds27

About N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine

N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine (PubChem CID 161390712) has the molecular formula C133H127F3N30O7S3 and a molecular weight of 2410.88 g/mol. Its IUPAC name is N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine.

Molecular Properties

Compound NameN-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
PubChem CID161390712
Molecular FormulaC133H127F3N30O7S3
Molecular Weight2410.88 g/mol
Exact Mass2408.96
IUPAC NameN-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
SMILESC=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCC(F)(F)C1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCC(S(C)(=O)=O)C1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCCS(=O)(=O)CC1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCNCC1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CC[C@@H](F)C1.CS(=O)(=O)CCNC(=O)c1cccc2cc(Cc3[nH]nc4cccnc34)ccc12
InChIInChI=1S/2C23H23N5O2S.C22H19F2N5.C22H20FN5.C22H22N6.C21H20N4O3S/c1-15(28-12-10-18(14-28)31(2,29)30)19-6-3-5-16-13-17(8-9-20(16)19)25-23-22-21(26-27-23)7-4-11-24-22;1-16(28-11-4-13-31(29,30)14-12-28)19-6-2-5-17-15-18(8-9-20(17)19)25-23-22-21(26-27-23)7-3-10-24-22;1-14(29-11-9-22(23,24)13-29)17-5-2-4-15-12-16(7-8-18(15)17)26-21-20-19(27-28-21)6-3-10-25-20;1-14(28-11-9-16(23)13-28)18-5-2-4-15-12-17(7-8-19(15)18)25-22-21-20(26-27-22)6-3-10-24-21;1-15(28-12-10-23-11-13-28)18-5-2-4-16-14-17(7-8-19(16)18)25-22-21-20(26-27-22)6-3-9-24-21;1-29(27,28)11-10-23-21(26)17-5-2-4-15-12-14(7-8-16(15)17)13-19-20-18(24-25-19)6-3-9-22-20/h3-9,11,13,18H,1,10,12,14H2,2H3,(H2,25,26,27);2-3,5-10,15H,1,4,11-14H2,(H2,25,26,27);2-8,10,12H,1,9,11,13H2,(H2,26,27,28);2-8,10,12,16H,1,9,11,13H2,(H2,25,26,27);2-9,14,23H,1,10-13H2,(H2,25,26,27);2-9,12H,10-11,13H2,1H3,(H,23,26)(H,24,25)/t;;;16-;;/m...1../s1
InChIKeyVSYJOIXHEPHXMY-WWPSXCDTSA-N
XLogP24.13
TPSA469.32 Ų
H-Bond Donors13
H-Bond Acceptors30
Rotatable Bonds27
Heavy Atoms176
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002410.88
LogP ≤ 524.13
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1030

Analyze N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine with MolForge

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Related Compounds

azepan-1-yl-[6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)isoquinolin-1-yl]methanone;(3,3-difluoropiperidin-1-yl)-[6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)isoquinolin-1-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-[6-(2H-pyrazolo[3,4-b]pyridin-3-ylamino)isoquinolin-1-yl]methanone;bis(piperidin-1-yl-[6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)isoquinolin-1-yl]methanone)
CID 157162758
1-[5-[2-[5-[5-[(benzylamino)methyl]-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]thiophen-2-yl]ethanone;1-[5-[2-[5-[5-[(cyclopentylmethylamino)methyl]-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]thiophen-2-yl]ethanone;2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-7-[3-fluoro-5-(2-methylsulfonylethyl)phenyl]-3H-imidazo[4,5-c]pyridine;N-[3-[2-[5-[5-[(3,3-difluoropyrrolidin-1-yl)methyl]-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]-5-fluorophenyl]-N',N'-dimethylethane-1,2-diamine
CID 157269542
2-methyl-N-(4-methylphenyl)-5-[3-(1H-pyrazol-5-yl)imidazo[1,5-a]pyridin-8-yl]benzamide;bis(N-(4-methylphenyl)-5-(3-pyridin-2-ylimidazo[1,5-a]pyridin-8-yl)-2-(trifluoromethyl)benzamide);N-(4-methylphenyl)-5-(3-pyrimidin-4-ylimidazo[1,5-a]pyridin-8-yl)-2-(trifluoromethyl)benzamide
CID 157377466
1-(1,1-difluorobutyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;1-(1,1-difluorobutyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)isoquinolin-6-amine;N-(3,3-difluorocyclobutyl)-N-methyl-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalene-1-carboxamide;1-(1,1-difluoroethyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;1-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine
CID 157684937
N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(1,4-oxazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-[1-[6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-yl]ethenyl]piperidine-4-carboxamide
CID 157827403
5-[4-[(5-butyl-1H-pyrazol-3-yl)amino]-6-cyclopropyl-1,3,5-triazin-2-yl]-1,2-dihydroindazol-3-one;5-[4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-6-phenyl-1,3,5-triazin-2-yl]-1,2-dihydroindazol-3-one;5-[4-(1H-indazol-3-ylamino)-6-thiomorpholin-4-yl-1,3,5-triazin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one;5-[4-[(5-methyl-1H-pyrazol-3-yl)amino]-1,7-naphthyridin-2-yl]-6-(trifluoromethyl)-1,2-dihydroindazol-3-one
CID 157887985
1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)isoquinolin-6-amine;1-(difluoromethyl)-N-(1H-indazol-3-yl)isoquinolin-6-amine;(4-fluoro-4-methylpiperidin-1-yl)-[6-(2H-pyrazolo[3,4-b]pyrazin-3-ylamino)naphthalen-1-yl]methanone;1-(2-fluoropropan-2-yl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)isoquinolin-6-amine
CID 157972714
(3,3-difluoropiperidin-1-yl)-[6-(2H-pyrazolo[3,4-b]pyridin-3-ylamino)isoquinolin-1-yl]methanone;(4-fluoro-4-methylpiperidin-1-yl)-[6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)isoquinolin-1-yl]methanone;(4-methylpiperazin-1-yl)-[6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)isoquinolin-1-yl]methanone;[(3S)-3-methylpyrrolidin-1-yl]-[6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)isoquinolin-1-yl]methanone;[(3S)-3-methylpyrrolidin-1-yl]-[6-(2H-pyrazolo[3,4-b]pyridin-3-ylamino)isoquinolin-1-yl]methanone
CID 157997463
N-(3,3-difluorocyclobutyl)-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalene-1-carboxamide;N-(3-fluorocyclobutyl)-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalene-1-carboxamide;N-[5-[1-[(3S)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(4-methylsulfonylpiperazin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(3-methylsulfonylpropyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;1-[4-[1-[6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalen-1-yl]ethenyl]piperazin-1-yl]ethanone
CID 158124679
N-(3,3-difluorocyclobutyl)-N-methyl-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalene-1-carboxamide;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)isoquinolin-6-amine;1-(1,1-difluoroethyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;1-(1,1-difluoroethyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)isoquinolin-6-amine
CID 158320957
N-(3,3-difluorocyclobutyl)-6-(1H-pyrazolo[4,3-b]pyridin-3-ylamino)naphthalene-1-carboxamide;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(4-methylsulfonylpiperazin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine
CID 158618792
3-[2-(2-amino-[1,2,4]triazolo[1,5-a]pyridin-7-yl)ethynyl]-4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide;1-[3-[2-(7H-cyclopenta[b]pyrazin-3-yl)ethynyl]-4-methylphenyl]-3-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]propan-2-one;4-methyl-3-[2-[2-(methylamino)-[1,2,4]triazolo[1,5-a]pyridin-7-yl]ethynyl]-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]benzamide;4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[2-(5H-pyrrolo[2,3-b]pyrazin-2-yl)ethynyl]benzamide;1-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[4-methyl-3-[2-(1H-pyrazolo[5,4-b]pyridin-5-yl)ethynyl]phenyl]propan-2-one
CID 158751476

Frequently Asked Questions

What is the IUPAC name of N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The IUPAC name of N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine (CID 161390712) is N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine.
What is the SMILES notation for N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The canonical SMILES for N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine is C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCC(F)(F)C1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCC(S(C)(=O)=O)C1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCCS(=O)(=O)CC1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CCNCC1.C=C(c1cccc2cc(Nc3n[nH]c4cccnc34)ccc12)N1CC[C@@H](F)C1.CS(=O)(=O)CCNC(=O)c1cccc2cc(Cc3[nH]nc4cccnc34)ccc12.
What is the InChIKey of N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
The InChIKey is VSYJOIXHEPHXMY-WWPSXCDTSA-N. The full InChI is InChI=1S/2C23H23N5O2S.C22H19F2N5.C22H20FN5.C22H22N6.C21H20N4O3S/c1-15(28-12-10-18(14-28)31(2,29)30)19-6-3-5-16-13-17(8-9-20(16)19)25-23-22-21(26-27-23)7-4-11-24-22;1-16(28-11-4-13-31(29,30)14-12-28)19-6-2-5-17-15-18(8-9-20(17)19)25-23-22-21(26-27-23)7-3-10-24-22;1-14(29-11-9-22(23,24)13-29)17-5-2-4-15-12-16(7-8-18(15)17)26-21-20-19(27-28-21)6-3-10-25-20;1-14(28-11-9-16(23)13-28)18-5-2-4-15-12-17(7-8-19(15)18)25-22-21-20(26-27-22)6-3-10-24-21;1-15(28-12-10-23-11-13-28)18-5-2-4-16-14-17(7-8-19(16)18)25-22-21-20(26-27-22)6-3-9-24-21;1-29(27,28)11-10-23-21(26)17-5-2-4-15-12-14(7-8-16(15)17)13-19-20-18(24-25-19)6-3-9-22-20/h3-9,11,13,18H,1,10,12,14H2,2H3,(H2,25,26,27);2-3,5-10,15H,1,4,11-14H2,(H2,25,26,27);2-8,10,12H,1,9,11,13H2,(H2,26,27,28);2-8,10,12,16H,1,9,11,13H2,(H2,25,26,27);2-9,14,23H,1,10-13H2,(H2,25,26,27);2-9,12H,10-11,13H2,1H3,(H,23,26)(H,24,25)/t;;;16-;;/m...1../s1.
What are the key properties of N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine?
N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine has a molecular weight of 2410.88 g/mol, XLogP of 24.13, 27 rotatable bonds, 13 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[1-(3,3-difluoropyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-(1,1-dioxo-1,4-thiazepan-4-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-[1-[(3R)-3-fluoropyrrolidin-1-yl]ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-(2-methylsulfonylethyl)-6-(2H-pyrazolo[4,3-b]pyridin-3-ylmethyl)naphthalene-1-carboxamide;N-[5-[1-(3-methylsulfonylpyrrolidin-1-yl)ethenyl]naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;N-[5-(1-piperazin-1-ylethenyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine is sourced from PubChem (CID 161390712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).