3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide

C227H236F9N47O11S11 — CID 167549982

IUPAC3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCc1ccc2c(N)c(C(=O)N[C@@H]3CCc4c(C#N)c(N5CC6CCC(C6)C5)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@@H]3CCc4c(C#N)c(N5CC6CCCC(C5)O6)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CC6CCC(C6)C5)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CC6CCCC(C5)O6)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)sc2n1.Cc1cnc2c(N)c(C(=O)N[C@@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)sc2n1.Cc1cnc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)sc2n1.Cc1nc2sc(C(=O)N[C@@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)c(N)c2s1.Cc1nc2sc(C(=O)N[C@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)c(N)c2s1
InChIInChI=1S/2C27H28FN5O2S.2C27H28FN5OS.C25H26FN5OS.2C24H25FN6OS.2C23H24FN5OS2/c2*1-14-5-7-19-24(30)25(36-27(19)31-14)26(34)32-15-6-8-18-20(9-15)22(28)10-23(21(18)11-29)33-12-16-3-2-4-17(13-33)35-16;2*1-14-2-6-19-24(30)25(35-27(19)31-14)26(34)32-17-5-7-18-20(9-17)22(28)10-23(21(18)11-29)33-12-15-3-4-16(8-15)13-33;1-14-5-7-17-22(28)23(33-25(17)29-14)24(32)30-15-6-8-16-18(11-15)20(26)12-21(19(16)13-27)31-9-3-2-4-10-31;2*1-13-12-28-21-20(27)22(33-24(21)29-13)23(32)30-14-5-6-15-16(9-14)18(25)10-19(17(15)11-26)31-7-3-2-4-8-31;2*1-12-27-23-21(31-12)19(26)20(32-23)22(30)28-13-5-6-14-15(9-13)17(24)10-18(16(14)11-25)29-7-3-2-4-8-29/h2*5,7,10,15-17H,2-4,6,8-9,12-13,30H2,1H3,(H,32,34);2*2,6,10,15-17H,3-5,7-9,12-13,30H2,1H3,(H,32,34);5,7,12,15H,2-4,6,8-11,28H2,1H3,(H,30,32);2*10,12,14H,2-9,27H2,1H3,(H,30,32);2*10,13H,2-9,26H2,1H3,(H,28,30)/t2*15-,16?,17?;2*15?,16?,17-;15-;2*14-;2*13-/m101001010/s1
InChIKeyCGVWDXRDLCLGPA-GOIZALJISA-N
MW4322.42 g/mol
LogP39.22
Rot. Bonds27

About 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide

3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide (PubChem CID 167549982) has the molecular formula C227H236F9N47O11S11 and a molecular weight of 4322.42 g/mol. Its IUPAC name is 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound Name3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide
PubChem CID167549982
Molecular FormulaC227H236F9N47O11S11
Molecular Weight4322.42 g/mol
Exact Mass4318.61
IUPAC Name3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide
SMILESCc1ccc2c(N)c(C(=O)N[C@@H]3CCc4c(C#N)c(N5CC6CCC(C6)C5)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@@H]3CCc4c(C#N)c(N5CC6CCCC(C5)O6)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CC6CCC(C6)C5)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CC6CCCC(C5)O6)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)sc2n1.Cc1cnc2c(N)c(C(=O)N[C@@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)sc2n1.Cc1cnc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)sc2n1.Cc1nc2sc(C(=O)N[C@@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)c(N)c2s1.Cc1nc2sc(C(=O)N[C@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)c(N)c2s1
InChIInChI=1S/2C27H28FN5O2S.2C27H28FN5OS.C25H26FN5OS.2C24H25FN6OS.2C23H24FN5OS2/c2*1-14-5-7-19-24(30)25(36-27(19)31-14)26(34)32-15-6-8-18-20(9-15)22(28)10-23(21(18)11-29)33-12-16-3-2-4-17(13-33)35-16;2*1-14-2-6-19-24(30)25(35-27(19)31-14)26(34)32-17-5-7-18-20(9-17)22(28)10-23(21(18)11-29)33-12-15-3-4-16(8-15)13-33;1-14-5-7-17-22(28)23(33-25(17)29-14)24(32)30-15-6-8-16-18(11-15)20(26)12-21(19(16)13-27)31-9-3-2-4-10-31;2*1-13-12-28-21-20(27)22(33-24(21)29-13)23(32)30-14-5-6-15-16(9-14)18(25)10-19(17(15)11-26)31-7-3-2-4-8-31;2*1-12-27-23-21(31-12)19(26)20(32-23)22(30)28-13-5-6-14-15(9-13)17(24)10-18(16(14)11-25)29-7-3-2-4-8-29/h2*5,7,10,15-17H,2-4,6,8-9,12-13,30H2,1H3,(H,32,34);2*2,6,10,15-17H,3-5,7-9,12-13,30H2,1H3,(H,32,34);5,7,12,15H,2-4,6,8-11,28H2,1H3,(H,30,32);2*10,12,14H,2-9,27H2,1H3,(H,30,32);2*10,13H,2-9,26H2,1H3,(H,28,30)/t2*15-,16?,17?;2*15?,16?,17-;15-;2*14-;2*13-/m101001010/s1
InChIKeyCGVWDXRDLCLGPA-GOIZALJISA-N
XLogP39.22
TPSA899.60 Ų
H-Bond Donors18
H-Bond Acceptors60
Rotatable Bonds27
Heavy Atoms305
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004322.42
LogP ≤ 539.22
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 1060

Analyze 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The IUPAC name of 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide (CID 167549982) is 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide.
What is the SMILES notation for 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The canonical SMILES for 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide is Cc1ccc2c(N)c(C(=O)N[C@@H]3CCc4c(C#N)c(N5CC6CCC(C6)C5)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@@H]3CCc4c(C#N)c(N5CC6CCCC(C5)O6)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CC6CCC(C6)C5)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CC6CCCC(C5)O6)cc(F)c4C3)sc2n1.Cc1ccc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)sc2n1.Cc1cnc2c(N)c(C(=O)N[C@@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)sc2n1.Cc1cnc2c(N)c(C(=O)N[C@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)sc2n1.Cc1nc2sc(C(=O)N[C@@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)c(N)c2s1.Cc1nc2sc(C(=O)N[C@H]3CCc4c(C#N)c(N5CCCCC5)cc(F)c4C3)c(N)c2s1.
What is the InChIKey of 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide?
The InChIKey is CGVWDXRDLCLGPA-GOIZALJISA-N. The full InChI is InChI=1S/2C27H28FN5O2S.2C27H28FN5OS.C25H26FN5OS.2C24H25FN6OS.2C23H24FN5OS2/c2*1-14-5-7-19-24(30)25(36-27(19)31-14)26(34)32-15-6-8-18-20(9-15)22(28)10-23(21(18)11-29)33-12-16-3-2-4-17(13-33)35-16;2*1-14-2-6-19-24(30)25(35-27(19)31-14)26(34)32-17-5-7-18-20(9-17)22(28)10-23(21(18)11-29)33-12-15-3-4-16(8-15)13-33;1-14-5-7-17-22(28)23(33-25(17)29-14)24(32)30-15-6-8-16-18(11-15)20(26)12-21(19(16)13-27)31-9-3-2-4-10-31;2*1-13-12-28-21-20(27)22(33-24(21)29-13)23(32)30-14-5-6-15-16(9-14)18(25)10-19(17(15)11-26)31-7-3-2-4-8-31;2*1-12-27-23-21(31-12)19(26)20(32-23)22(30)28-13-5-6-14-15(9-13)17(24)10-18(16(14)11-25)29-7-3-2-4-8-29/h2*5,7,10,15-17H,2-4,6,8-9,12-13,30H2,1H3,(H,32,34);2*2,6,10,15-17H,3-5,7-9,12-13,30H2,1H3,(H,32,34);5,7,12,15H,2-4,6,8-11,28H2,1H3,(H,30,32);2*10,12,14H,2-9,27H2,1H3,(H,30,32);2*10,13H,2-9,26H2,1H3,(H,28,30)/t2*15-,16?,17?;2*15?,16?,17-;15-;2*14-;2*13-/m101001010/s1.
What are the key properties of 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide?
3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide has a molecular weight of 4322.42 g/mol, XLogP of 39.22, 27 rotatable bonds, 18 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(2S)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-6-(3-azabicyclo[3.2.1]octan-3-yl)-5-cyano-8-fluoro-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;3-amino-N-[(2R)-5-cyano-8-fluoro-6-(9-oxa-3-azabicyclo[3.3.1]nonan-3-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;7-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;7-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-3-methylthieno[2,3-b]pyrazine-6-carboxamide;3-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-6-methylthieno[2,3-b]pyridine-2-carboxamide;6-amino-N-[(2S)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide;6-amino-N-[(2R)-5-cyano-8-fluoro-6-piperidin-1-yl-1,2,3,4-tetrahydronaphthalen-2-yl]-2-methylthieno[2,3-d][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 167549982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).