2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide

C317H317F2N87O16 — CID 158373516

IUPAC2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide
SMILESCNC(=O)c1cc(Nc2cc3cc(-c4ccccc4C)nc(N)c3cn2)nn1C.Cc1cc(Nc2cc3cc(-c4ccccc4C)nc(N)c3cn2)n(CCO)n1.Cc1ccccc1-c1cc2cc(NC(=O)C3[C@H]4CN(C5COC5)C[C@@H]34)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cc(C)n(CCO)n3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cc(C4CC4)n(CCO)n3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cc4n(n3)CC(=O)N(C)CC4)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn(CC(C)(C)O)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn(CC(F)F)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn([C@@H]4CCCN(C)C4=O)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn([C@H]4CCCN(C)C4=O)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn([C@H]4CCN(C)C4=O)c3)ncc2c(N)n1.Cc1ccncc1-c1nc(N)c2cnc(NC(=O)C3CC3)cc2c1-c1cn[nH]c1.Nc1nc(-c2ccccc2CCO)cc2cc(NC(=O)[C@@H]3C[C@H]3c3cccnc3)ncc12.Nc1nc(-c2ccccc2CCO)cc2cc(NC(=O)[C@H]3C[C@@H]3c3cccnc3)ncc12
InChIInChI=1S/2C25H23N5O2.2C24H25N7O.C24H25N5O2.2C23H23N7O.C23H24N6O.C22H24N6O.C21H19N7O.C21H21N7O.2C21H22N6O.C20H18F2N6/c2*26-24-21-14-28-23(30-25(32)20-12-19(20)16-5-3-8-27-13-16)11-17(21)10-22(29-24)18-6-2-1-4-15(18)7-9-31;2*1-15-6-3-4-7-18(15)20-10-16-11-22(26-13-19(16)23(25)29-20)28-17-12-27-31(14-17)21-8-5-9-30(2)24(21)32;1-13-4-2-3-5-16(13)20-6-14-7-21(26-8-17(14)23(25)27-20)28-24(30)22-18-9-29(10-19(18)22)15-11-31-12-15;1-14-5-3-4-6-17(14)19-9-15-10-21(25-12-18(15)22(24)28-19)27-16-11-26-30(13-16)20-7-8-29(2)23(20)31;1-14-5-3-4-6-17(14)19-9-15-10-20(25-12-18(15)23(24)26-19)27-21-11-16-7-8-29(2)22(31)13-30(16)28-21;1-14-4-2-3-5-17(14)19-10-16-11-21(25-13-18(16)23(24)26-19)27-22-12-20(15-6-7-15)29(28-22)8-9-30;1-14-6-4-5-7-17(14)19-8-15-9-20(24-11-18(15)21(23)27-19)26-16-10-25-28(12-16)13-22(2,3)29;1-11-4-5-23-9-15(11)19-18(13-7-25-26-8-13)14-6-17(27-21(29)12-2-3-12)24-10-16(14)20(22)28-19;1-12-6-4-5-7-14(12)16-8-13-9-18(24-11-15(13)20(22)25-16)26-19-10-17(21(29)23-2)28(3)27-19;1-13-5-3-4-6-16(13)18-10-15-11-19(23-12-17(15)21(22)24-18)25-20-9-14(2)27(26-20)7-8-28;1-13-5-3-4-6-16(13)18-10-15-11-19(23-12-17(15)21(22)24-18)25-20-9-14(2)26-27(20)7-8-28;1-12-4-2-3-5-15(12)17-6-13-7-19(24-9-16(13)20(23)27-17)26-14-8-25-28(10-14)11-18(21)22/h2*1-6,8,10-11,13-14,19-20,31H,7,9,12H2,(H2,26,29)(H,28,30,32);2*3-4,6-7,10-14,21H,5,8-9H2,1-2H3,(H2,25,29)(H,26,28);2-8,15,18-19,22H,9-12H2,1H3,(H2,25,27)(H,26,28,30);3-6,9-13,20H,7-8H2,1-2H3,(H2,24,28)(H,25,27);3-6,9-12H,7-8,13H2,1-2H3,(H2,24,26)(H,25,27,28);2-5,10-13,15,30H,6-9H2,1H3,(H2,24,26)(H,25,27,28);4-12,29H,13H2,1-3H3,(H2,23,27)(H,24,26);4-10,12H,2-3H2,1H3,(H2,22,28)(H,25,26)(H,24,27,29);4-11H,1-3H3,(H2,22,25)(H,23,29)(H,24,26,27);3-6,9-12,28H,7-8H2,1-2H3,(H2,22,24)(H,23,25,26);3-6,9-12,28H,7-8H2,1-2H3,(H2,22,24)(H,23,25);2-10,18H,11H2,1H3,(H2,23,27)(H,24,26)/t2*19-,20+;2*21-;18-,19+,22?;20-;;;;;;;;/m1010.0......../s1
InChIKeyGUXKMJZIRFRREJ-JWEMAUMCSA-N
MW5639.61 g/mol
LogP49.81
Rot. Bonds65

About 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide

2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide (PubChem CID 158373516) has the molecular formula C317H317F2N87O16 and a molecular weight of 5639.61 g/mol. Its IUPAC name is 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide
PubChem CID158373516
Molecular FormulaC317H317F2N87O16
Molecular Weight5639.61 g/mol
Exact Mass5635.66
IUPAC Name2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide
SMILESCNC(=O)c1cc(Nc2cc3cc(-c4ccccc4C)nc(N)c3cn2)nn1C.Cc1cc(Nc2cc3cc(-c4ccccc4C)nc(N)c3cn2)n(CCO)n1.Cc1ccccc1-c1cc2cc(NC(=O)C3[C@H]4CN(C5COC5)C[C@@H]34)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cc(C)n(CCO)n3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cc(C4CC4)n(CCO)n3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cc4n(n3)CC(=O)N(C)CC4)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn(CC(C)(C)O)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn(CC(F)F)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn([C@@H]4CCCN(C)C4=O)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn([C@H]4CCCN(C)C4=O)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn([C@H]4CCN(C)C4=O)c3)ncc2c(N)n1.Cc1ccncc1-c1nc(N)c2cnc(NC(=O)C3CC3)cc2c1-c1cn[nH]c1.Nc1nc(-c2ccccc2CCO)cc2cc(NC(=O)[C@@H]3C[C@H]3c3cccnc3)ncc12.Nc1nc(-c2ccccc2CCO)cc2cc(NC(=O)[C@H]3C[C@@H]3c3cccnc3)ncc12
InChIInChI=1S/2C25H23N5O2.2C24H25N7O.C24H25N5O2.2C23H23N7O.C23H24N6O.C22H24N6O.C21H19N7O.C21H21N7O.2C21H22N6O.C20H18F2N6/c2*26-24-21-14-28-23(30-25(32)20-12-19(20)16-5-3-8-27-13-16)11-17(21)10-22(29-24)18-6-2-1-4-15(18)7-9-31;2*1-15-6-3-4-7-18(15)20-10-16-11-22(26-13-19(16)23(25)29-20)28-17-12-27-31(14-17)21-8-5-9-30(2)24(21)32;1-13-4-2-3-5-16(13)20-6-14-7-21(26-8-17(14)23(25)27-20)28-24(30)22-18-9-29(10-19(18)22)15-11-31-12-15;1-14-5-3-4-6-17(14)19-9-15-10-21(25-12-18(15)22(24)28-19)27-16-11-26-30(13-16)20-7-8-29(2)23(20)31;1-14-5-3-4-6-17(14)19-9-15-10-20(25-12-18(15)23(24)26-19)27-21-11-16-7-8-29(2)22(31)13-30(16)28-21;1-14-4-2-3-5-17(14)19-10-16-11-21(25-13-18(16)23(24)26-19)27-22-12-20(15-6-7-15)29(28-22)8-9-30;1-14-6-4-5-7-17(14)19-8-15-9-20(24-11-18(15)21(23)27-19)26-16-10-25-28(12-16)13-22(2,3)29;1-11-4-5-23-9-15(11)19-18(13-7-25-26-8-13)14-6-17(27-21(29)12-2-3-12)24-10-16(14)20(22)28-19;1-12-6-4-5-7-14(12)16-8-13-9-18(24-11-15(13)20(22)25-16)26-19-10-17(21(29)23-2)28(3)27-19;1-13-5-3-4-6-16(13)18-10-15-11-19(23-12-17(15)21(22)24-18)25-20-9-14(2)27(26-20)7-8-28;1-13-5-3-4-6-16(13)18-10-15-11-19(23-12-17(15)21(22)24-18)25-20-9-14(2)26-27(20)7-8-28;1-12-4-2-3-5-15(12)17-6-13-7-19(24-9-16(13)20(23)27-17)26-14-8-25-28(10-14)11-18(21)22/h2*1-6,8,10-11,13-14,19-20,31H,7,9,12H2,(H2,26,29)(H,28,30,32);2*3-4,6-7,10-14,21H,5,8-9H2,1-2H3,(H2,25,29)(H,26,28);2-8,15,18-19,22H,9-12H2,1H3,(H2,25,27)(H,26,28,30);3-6,9-13,20H,7-8H2,1-2H3,(H2,24,28)(H,25,27);3-6,9-12H,7-8,13H2,1-2H3,(H2,24,26)(H,25,27,28);2-5,10-13,15,30H,6-9H2,1H3,(H2,24,26)(H,25,27,28);4-12,29H,13H2,1-3H3,(H2,23,27)(H,24,26);4-10,12H,2-3H2,1H3,(H2,22,28)(H,25,26)(H,24,27,29);4-11H,1-3H3,(H2,22,25)(H,23,29)(H,24,26,27);3-6,9-12,28H,7-8H2,1-2H3,(H2,22,24)(H,23,25,26);3-6,9-12,28H,7-8H2,1-2H3,(H2,22,24)(H,23,25);2-10,18H,11H2,1H3,(H2,23,27)(H,24,26)/t2*19-,20+;2*21-;18-,19+,22?;20-;;;;;;;;/m1010.0......../s1
InChIKeyGUXKMJZIRFRREJ-JWEMAUMCSA-N
XLogP49.81
TPSA1451.64 Ų
H-Bond Donors36
H-Bond Acceptors93
Rotatable Bonds65
Heavy Atoms422
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005639.61
LogP ≤ 549.81
H-Bond Donors ≤ 536
H-Bond Acceptors ≤ 1093

Analyze 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide?
The IUPAC name of 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide (CID 158373516) is 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide.
What is the SMILES notation for 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide?
The canonical SMILES for 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide is CNC(=O)c1cc(Nc2cc3cc(-c4ccccc4C)nc(N)c3cn2)nn1C.Cc1cc(Nc2cc3cc(-c4ccccc4C)nc(N)c3cn2)n(CCO)n1.Cc1ccccc1-c1cc2cc(NC(=O)C3[C@H]4CN(C5COC5)C[C@@H]34)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cc(C)n(CCO)n3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cc(C4CC4)n(CCO)n3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cc4n(n3)CC(=O)N(C)CC4)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn(CC(C)(C)O)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn(CC(F)F)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn([C@@H]4CCCN(C)C4=O)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn([C@H]4CCCN(C)C4=O)c3)ncc2c(N)n1.Cc1ccccc1-c1cc2cc(Nc3cnn([C@H]4CCN(C)C4=O)c3)ncc2c(N)n1.Cc1ccncc1-c1nc(N)c2cnc(NC(=O)C3CC3)cc2c1-c1cn[nH]c1.Nc1nc(-c2ccccc2CCO)cc2cc(NC(=O)[C@@H]3C[C@H]3c3cccnc3)ncc12.Nc1nc(-c2ccccc2CCO)cc2cc(NC(=O)[C@H]3C[C@@H]3c3cccnc3)ncc12.
What is the InChIKey of 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide?
The InChIKey is GUXKMJZIRFRREJ-JWEMAUMCSA-N. The full InChI is InChI=1S/2C25H23N5O2.2C24H25N7O.C24H25N5O2.2C23H23N7O.C23H24N6O.C22H24N6O.C21H19N7O.C21H21N7O.2C21H22N6O.C20H18F2N6/c2*26-24-21-14-28-23(30-25(32)20-12-19(20)16-5-3-8-27-13-16)11-17(21)10-22(29-24)18-6-2-1-4-15(18)7-9-31;2*1-15-6-3-4-7-18(15)20-10-16-11-22(26-13-19(16)23(25)29-20)28-17-12-27-31(14-17)21-8-5-9-30(2)24(21)32;1-13-4-2-3-5-16(13)20-6-14-7-21(26-8-17(14)23(25)27-20)28-24(30)22-18-9-29(10-19(18)22)15-11-31-12-15;1-14-5-3-4-6-17(14)19-9-15-10-21(25-12-18(15)22(24)28-19)27-16-11-26-30(13-16)20-7-8-29(2)23(20)31;1-14-5-3-4-6-17(14)19-9-15-10-20(25-12-18(15)23(24)26-19)27-21-11-16-7-8-29(2)22(31)13-30(16)28-21;1-14-4-2-3-5-17(14)19-10-16-11-21(25-13-18(16)23(24)26-19)27-22-12-20(15-6-7-15)29(28-22)8-9-30;1-14-6-4-5-7-17(14)19-8-15-9-20(24-11-18(15)21(23)27-19)26-16-10-25-28(12-16)13-22(2,3)29;1-11-4-5-23-9-15(11)19-18(13-7-25-26-8-13)14-6-17(27-21(29)12-2-3-12)24-10-16(14)20(22)28-19;1-12-6-4-5-7-14(12)16-8-13-9-18(24-11-15(13)20(22)25-16)26-19-10-17(21(29)23-2)28(3)27-19;1-13-5-3-4-6-16(13)18-10-15-11-19(23-12-17(15)21(22)24-18)25-20-9-14(2)27(26-20)7-8-28;1-13-5-3-4-6-16(13)18-10-15-11-19(23-12-17(15)21(22)24-18)25-20-9-14(2)26-27(20)7-8-28;1-12-4-2-3-5-15(12)17-6-13-7-19(24-9-16(13)20(23)27-17)26-14-8-25-28(10-14)11-18(21)22/h2*1-6,8,10-11,13-14,19-20,31H,7,9,12H2,(H2,26,29)(H,28,30,32);2*3-4,6-7,10-14,21H,5,8-9H2,1-2H3,(H2,25,29)(H,26,28);2-8,15,18-19,22H,9-12H2,1H3,(H2,25,27)(H,26,28,30);3-6,9-13,20H,7-8H2,1-2H3,(H2,24,28)(H,25,27);3-6,9-12H,7-8,13H2,1-2H3,(H2,24,26)(H,25,27,28);2-5,10-13,15,30H,6-9H2,1H3,(H2,24,26)(H,25,27,28);4-12,29H,13H2,1-3H3,(H2,23,27)(H,24,26);4-10,12H,2-3H2,1H3,(H2,22,28)(H,25,26)(H,24,27,29);4-11H,1-3H3,(H2,22,25)(H,23,29)(H,24,26,27);3-6,9-12,28H,7-8H2,1-2H3,(H2,22,24)(H,23,25,26);3-6,9-12,28H,7-8H2,1-2H3,(H2,22,24)(H,23,25);2-10,18H,11H2,1H3,(H2,23,27)(H,24,26)/t2*19-,20+;2*21-;18-,19+,22?;20-;;;;;;;;/m1010.0......../s1.
What are the key properties of 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide?
2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide has a molecular weight of 5639.61 g/mol, XLogP of 49.81, 65 rotatable bonds, 36 hydrogen bond donors, and 93 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-cyclopropylpyrazol-1-yl]ethanol;3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-N,1-dimethylpyrazole-5-carboxamide;2-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-6-methyl-5,8-dihydro-4H-pyrazolo[1,5-d][1,4]diazepin-7-one;2-[3-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-5-methylpyrazol-1-yl]ethanol;2-[5-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]-3-methylpyrazol-1-yl]ethanol;(3R)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpiperidin-2-one;1-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-2-methylpropan-2-ol;(3S)-3-[4-[[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]amino]pyrazol-1-yl]-1-methylpyrrolidin-2-one;(1S,5R)-N-[8-amino-6-(2-methylphenyl)-2,7-naphthyridin-3-yl]-3-(oxetan-3-yl)-3-azabicyclo[3.1.0]hexane-6-carboxamide;N-[8-amino-6-(4-methyl-3-pyridinyl)-5-(1H-pyrazol-4-yl)-2,7-naphthyridin-3-yl]cyclopropanecarboxamide;6-N-[1-(2,2-difluoroethyl)pyrazol-4-yl]-3-(2-methylphenyl)-2,7-naphthyridine-1,6-diamine;trans-(1R,2R)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide;trans-(1S,2S)-N-[8-amino-6-[2-(2-hydroxyethyl)phenyl]-2,7-naphthyridin-3-yl]-2-pyridin-3-ylcyclopropane-1-carboxamide is sourced from PubChem (CID 158373516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).