N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide

C263H301F4N55O29S11 — CID 164992585

About N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide

N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide (PubChem CID 164992585) has the molecular formula C263H301F4N55O29S11 and a molecular weight of 5125.39 g/mol. Its IUPAC name is N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide.

Molecular Properties

• Compound Name: N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide
• PubChem CID: 164992585
• Molecular Formula: C263H301F4N55O29S11
• Molecular Weight: 5125.39 g/mol
• Exact Mass: 5121.06
• IUPAC Name: N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide
• SMILES: CC[C@@H]1C[C@@H](c2ccc3scnc3c2)N(C(=O)C(=O)Nc2cnc(OC)c(C(N)=O)c2)C[C@@H]1C.CC[C@H]1C[C@H](c2ccc3scnc3c2)N(C(=O)C(=O)Nc2cnc(N)c(C3CC3)c2)C[C@H]1C.CC[C@H]1C[C@H](c2ccc3scnc3c2)N(C(=O)C(=O)Nc2cnc(OC)c(C(N)=O)c2)C[C@H]1C.CCc1cc(NC(=O)C(=O)N2C[C@@H](C)[C@@H](CC)C[C@@H]2c2ccc3scnc3c2)cnc1N.CCc1cc(NC(=O)C(=O)N2C[C@@H](C)[C@@H](OC(C)C)C[C@@H]2c2ccc3scnc3c2)cnc1N.CCc1cc(NC(=O)C(=O)N2C[C@@H](C)[C@H](OC(C)C)C[C@@H]2c2ccc3scnc3c2)cnc1N.CO[C@@H]1C[C@@H](c2ccc3scnc3c2)N(C(=O)C(=O)Nc2cnc(N)c(C3CC3)c2)C[C@@H]1C.C[C@@H]1CN(C(=O)C(=O)Nc2cnc(N)c(C3CC3)c2)[C@@H](c2ccc3scnc3c2)CC1(C)F.C[C@H]1CN(C(=O)C(=O)Nc2cnc(N)c(C3CC3)c2)[C@H](c2ccc3scnc3c2)CC1(C)F.Cc1cc(NC(=O)C(=O)N2C[C@@H](C)C(C)(F)C[C@@H]2c2ccc3scnc3c2)cnc1N.Cc1cc(NC(=O)C(=O)N2C[C@H](C)C(C)(F)C[C@H]2c2ccc3scnc3c2)cnc1N
• InChI: InChI=1S/2C25H31N5O3S.C25H29N5O2S.2C24H26FN5O2S.2C24H27N5O4S.C24H27N5O3S.C24H29N5O2S.2C22H24FN5O2S/c2*1-5-16-8-18(11-27-23(16)26)29-24(31)25(32)30-12-15(4)21(33-14(2)3)10-20(30)17-6-7-22-19(9-17)28-13-34-22;1-3-15-9-21(17-6-7-22-20(8-17)28-13-33-22)30(12-14(15)2)25(32)24(31)29-18-10-19(16-4-5-16)23(26)27-11-18;2*1-13-11-30(19(9-24(13,2)25)15-5-6-20-18(7-15)28-12-33-20)23(32)22(31)29-16-8-17(14-3-4-14)21(26)27-10-16;2*1-4-14-8-19(15-5-6-20-18(7-15)27-12-34-20)29(11-13(14)2)24(32)22(31)28-16-9-17(21(25)30)23(33-3)26-10-16;1-13-11-29(19(9-20(13)32-2)15-5-6-21-18(7-15)27-12-33-21)24(31)23(30)28-16-8-17(14-3-4-14)22(25)26-10-16;1-4-15-10-20(17-6-7-21-19(9-17)27-13-32-21)29(12-14(15)3)24(31)23(30)28-18-8-16(5-2)22(25)26-11-18;2*1-12-6-15(9-25-19(12)24)27-20(29)21(30)28-10-13(2)22(3,23)8-17(28)14-4-5-18-16(7-14)26-11-31-18/h2*6-9,11,13-15,20-21H,5,10,12H2,1-4H3,(H2,26,27)(H,29,31);6-8,10-11,13-16,21H,3-5,9,12H2,1-2H3,(H2,26,27)(H,29,31);2*5-8,10,12-14,19H,3-4,9,11H2,1-2H3,(H2,26,27)(H,29,31);2*5-7,9-10,12-14,19H,4,8,11H2,1-3H3,(H2,25,30)(H,28,31);5-8,10,12-14,19-20H,3-4,9,11H2,1-2H3,(H2,25,26)(H,28,30);6-9,11,13-15,20H,4-5,10,12H2,1-3H3,(H2,25,26)(H,28,30);2*4-7,9,11,13,17H,8,10H2,1-3H3,(H2,24,25)(H,27,29)/t15-,20-,21+;15-,20-,21-;14-,15+,21-;2*13-,19-,24?;2*13-,14+,19-;13-,19-,20+;14-,15+,20-;2*13-,17-,22?/m11110100110/s1
• InChIKey: HBODZISCEJTJIF-KYUACXPMSA-N
• XLogP: 44.52
• TPSA: 1193.60 Ų
• H-Bond Donors: 22
• H-Bond Acceptors: 71
• Rotatable Bonds: 42
• Heavy Atoms: 362
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	5125.39
LogP ≤ 5	44.52
H-Bond Donors ≤ 5	22
H-Bond Acceptors ≤ 10	71

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide?

The IUPAC name of N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide (CID 164992585) is N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide.

What is the SMILES notation for N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide?

The canonical SMILES for N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide is CC[C@@H]1C[C@@H](c2ccc3scnc3c2)N(C(=O)C(=O)Nc2cnc(OC)c(C(N)=O)c2)C[C@@H]1C.CC[C@H]1C[C@H](c2ccc3scnc3c2)N(C(=O)C(=O)Nc2cnc(N)c(C3CC3)c2)C[C@H]1C.CC[C@H]1C[C@H](c2ccc3scnc3c2)N(C(=O)C(=O)Nc2cnc(OC)c(C(N)=O)c2)C[C@H]1C.CCc1cc(NC(=O)C(=O)N2C[C@@H](C)[C@@H](CC)C[C@@H]2c2ccc3scnc3c2)cnc1N.CCc1cc(NC(=O)C(=O)N2C[C@@H](C)[C@@H](OC(C)C)C[C@@H]2c2ccc3scnc3c2)cnc1N.CCc1cc(NC(=O)C(=O)N2C[C@@H](C)[C@H](OC(C)C)C[C@@H]2c2ccc3scnc3c2)cnc1N.CO[C@@H]1C[C@@H](c2ccc3scnc3c2)N(C(=O)C(=O)Nc2cnc(N)c(C3CC3)c2)C[C@@H]1C.C[C@@H]1CN(C(=O)C(=O)Nc2cnc(N)c(C3CC3)c2)[C@@H](c2ccc3scnc3c2)CC1(C)F.C[C@H]1CN(C(=O)C(=O)Nc2cnc(N)c(C3CC3)c2)[C@H](c2ccc3scnc3c2)CC1(C)F.Cc1cc(NC(=O)C(=O)N2C[C@@H](C)C(C)(F)C[C@@H]2c2ccc3scnc3c2)cnc1N.Cc1cc(NC(=O)C(=O)N2C[C@H](C)C(C)(F)C[C@H]2c2ccc3scnc3c2)cnc1N.

What is the InChIKey of N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide?

The InChIKey is HBODZISCEJTJIF-KYUACXPMSA-N. The full InChI is InChI=1S/2C25H31N5O3S.C25H29N5O2S.2C24H26FN5O2S.2C24H27N5O4S.C24H27N5O3S.C24H29N5O2S.2C22H24FN5O2S/c2*1-5-16-8-18(11-27-23(16)26)29-24(31)25(32)30-12-15(4)21(33-14(2)3)10-20(30)17-6-7-22-19(9-17)28-13-34-22;1-3-15-9-21(17-6-7-22-20(8-17)28-13-33-22)30(12-14(15)2)25(32)24(31)29-18-10-19(16-4-5-16)23(26)27-11-18;2*1-13-11-30(19(9-24(13,2)25)15-5-6-20-18(7-15)28-12-33-20)23(32)22(31)29-16-8-17(14-3-4-14)21(26)27-10-16;2*1-4-14-8-19(15-5-6-20-18(7-15)27-12-34-20)29(11-13(14)2)24(32)22(31)28-16-9-17(21(25)30)23(33-3)26-10-16;1-13-11-29(19(9-20(13)32-2)15-5-6-21-18(7-15)27-12-33-21)24(31)23(30)28-16-8-17(14-3-4-14)22(25)26-10-16;1-4-15-10-20(17-6-7-21-19(9-17)27-13-32-21)29(12-14(15)3)24(31)23(30)28-18-8-16(5-2)22(25)26-11-18;2*1-12-6-15(9-25-19(12)24)27-20(29)21(30)28-10-13(2)22(3,23)8-17(28)14-4-5-18-16(7-14)26-11-31-18/h2*6-9,11,13-15,20-21H,5,10,12H2,1-4H3,(H2,26,27)(H,29,31);6-8,10-11,13-16,21H,3-5,9,12H2,1-2H3,(H2,26,27)(H,29,31);2*5-8,10,12-14,19H,3-4,9,11H2,1-2H3,(H2,26,27)(H,29,31);2*5-7,9-10,12-14,19H,4,8,11H2,1-3H3,(H2,25,30)(H,28,31);5-8,10,12-14,19-20H,3-4,9,11H2,1-2H3,(H2,25,26)(H,28,30);6-9,11,13-15,20H,4-5,10,12H2,1-3H3,(H2,25,26)(H,28,30);2*4-7,9,11,13,17H,8,10H2,1-3H3,(H2,24,25)(H,27,29)/t15-,20-,21+;15-,20-,21-;14-,15+,21-;2*13-,19-,24?;2*13-,14+,19-;13-,19-,20+;14-,15+,20-;2*13-,17-,22?/m11110100110/s1.

What are the key properties of N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide?

N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide has a molecular weight of 5125.39 g/mol, XLogP of 44.52, 42 rotatable bonds, 22 hydrogen bond donors, and 71 hydrogen bond acceptors.

Where does this data come from?

All data for N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-cyclopropyl-3-pyridinyl)-2-[(2S,4R,5S)-2-(1,3-benzothiazol-5-yl)-4-methoxy-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4S,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-ethyl-3-pyridinyl)-2-[(2R,4R,5R)-2-(1,3-benzothiazol-5-yl)-5-methyl-4-propan-2-yloxypiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2R,5R)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-[(2S,5S)-2-(1,3-benzothiazol-5-yl)-4-fluoro-4,5-dimethylpiperidin-1-yl]-2-oxoacetamide;5-[[2-[(2R,4S,5S)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide;5-[[2-[(2S,4R,5R)-2-(1,3-benzothiazol-5-yl)-4-ethyl-5-methylpiperidin-1-yl]-2-oxoacetyl]amino]-2-methoxypyridine-3-carboxamide is sourced from PubChem (CID 164992585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).