tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate

C199H331N37O57S — CID 159438971

About tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate

tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate (PubChem CID 159438971) has the molecular formula C199H331N37O57S and a molecular weight of 4187.11 g/mol. Its IUPAC name is tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate.

Molecular Properties

• Compound Name: tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate
• PubChem CID: 159438971
• Molecular Formula: C199H331N37O57S
• Molecular Weight: 4187.11 g/mol
• Exact Mass: 4184.39
• IUPAC Name: tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate
• SMILES: C=CC(=O)OCC.CC(C)(C)OC(=O)N1CCC(N(CCC(=O)CNC(=O)[C@@H]2CC[C@@H]3CN2C(=O)N3OCc2ccccc2)C(=O)OC(C)(C)C)CC1.CC(C)(C)OC(=O)N1CCC(N(CCC(=O)NN)C(=O)OC(C)(C)C)CC1.CC(C)(C)OC(=O)N1CCC(N(CCc2nnc([C@@H]3CC[C@@H]4CN3C(=O)N4O)o2)C(=O)OC(C)(C)C)CC1.CC(C)(C)OC(=O)N1CCC(N(CCc2nnc([C@@H]3CC[C@@H]4CN3C(=O)N4OCc3ccccc3)o2)C(=O)OC(C)(C)C)CC1.CC(C)(C)OC(=O)N1CCC(N)CC1.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CCOC(=O)CCN(C(=O)OC(C)(C)C)C1CCN(C(=O)OC(C)(C)C)CC1.CCOC(=O)CCNC1CCN(C(=O)OC(C)(C)C)CC1.NN.O.O=C(O)[C@@H]1CC[C@@H]2CN1C(=O)N2OCc1ccccc1.O=C1N2C[C@@H](CC[C@H]2c2nnc(CCNC3CCNCC3)o2)N1OS(=O)(=O)O.[2H]CC
• InChI: InChI=1S/C33H49N5O8.C32H46N6O7.C25H40N6O7.C20H36N2O6.C18H34N4O5.C15H24N6O6S.C15H28N2O4.C14H16N2O4.C10H20N2O2.C10H18O5.C5H8O2.C2H6.H4N2.H2O/c1-32(2,3)45-30(42)35-17-14-24(15-18-35)36(31(43)46-33(4,5)6)19-16-26(39)20-34-28(40)27-13-12-25-21-37(27)29(41)38(25)44-22-23-10-8-7-9-11-23;1-31(2,3)44-29(40)35-17-14-23(15-18-35)36(30(41)45-32(4,5)6)19-16-26-33-34-27(43-26)25-13-12-24-20-37(25)28(39)38(24)42-21-22-10-8-7-9-11-22;1-24(2,3)37-22(33)28-12-9-16(10-13-28)29(23(34)38-25(4,5)6)14-11-19-26-27-20(36-19)18-8-7-17-15-30(18)21(32)31(17)35;1-8-26-16(23)11-14-22(18(25)28-20(5,6)7)15-9-12-21(13-10-15)17(24)27-19(2,3)4;1-17(2,3)26-15(24)21-10-7-13(8-11-21)22(12-9-14(23)20-19)16(25)27-18(4,5)6;22-15-20-9-11(21(15)27-28(23,24)25)1-2-12(20)14-19-18-13(26-14)5-8-17-10-3-6-16-7-4-10;1-5-20-13(18)6-9-16-12-7-10-17(11-8-12)14(19)21-15(2,3)4;17-13(18)12-7-6-11-8-15(12)14(19)16(11)20-9-10-4-2-1-3-5-10;1-10(2,3)14-9(13)12-6-4-8(11)5-7-12;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;1-3-5(6)7-4-2;2*1-2;/h7-11,24-25,27H,12-22H2,1-6H3,(H,34,40);7-11,23-25H,12-21H2,1-6H3;16-18,35H,7-15H2,1-6H3;15H,8-14H2,1-7H3;13H,7-12,19H2,1-6H3,(H,20,23);10-12,16-17H,1-9H2,(H,23,24,25);12,16H,5-11H2,1-4H3;1-5,11-12H,6-9H2,(H,17,18);8H,4-7,11H2,1-3H3;1-6H3;3H,1,4H2,2H3;1-2H3;1-2H2;1H2/t25-,27+;24-,25+;17-,18+;;;11-,12+;;11-,12+;;;;;;/m111..1.1....../s1/i;;;;;;;;;;;1D
• InChIKey: NQAMLPCWOBEKPI-OHYRLZKOSA-N
• XLogP: 25.58
• TPSA: 1125.48 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 67
• Rotatable Bonds: 50
• Heavy Atoms: 294
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4187.11
LogP ≤ 5	25.58
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	67

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate?

The IUPAC name of tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate (CID 159438971) is tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate.

What is the SMILES notation for tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate?

The canonical SMILES for tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate is C=CC(=O)OCC.CC(C)(C)OC(=O)N1CCC(N(CCC(=O)CNC(=O)[C@@H]2CC[C@@H]3CN2C(=O)N3OCc2ccccc2)C(=O)OC(C)(C)C)CC1.CC(C)(C)OC(=O)N1CCC(N(CCC(=O)NN)C(=O)OC(C)(C)C)CC1.CC(C)(C)OC(=O)N1CCC(N(CCc2nnc([C@@H]3CC[C@@H]4CN3C(=O)N4O)o2)C(=O)OC(C)(C)C)CC1.CC(C)(C)OC(=O)N1CCC(N(CCc2nnc([C@@H]3CC[C@@H]4CN3C(=O)N4OCc3ccccc3)o2)C(=O)OC(C)(C)C)CC1.CC(C)(C)OC(=O)N1CCC(N)CC1.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.CCOC(=O)CCN(C(=O)OC(C)(C)C)C1CCN(C(=O)OC(C)(C)C)CC1.CCOC(=O)CCNC1CCN(C(=O)OC(C)(C)C)CC1.NN.O.O=C(O)[C@@H]1CC[C@@H]2CN1C(=O)N2OCc1ccccc1.O=C1N2C[C@@H](CC[C@H]2c2nnc(CCNC3CCNCC3)o2)N1OS(=O)(=O)O.[2H]CC.

What is the InChIKey of tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate?

The InChIKey is NQAMLPCWOBEKPI-OHYRLZKOSA-N. The full InChI is InChI=1S/C33H49N5O8.C32H46N6O7.C25H40N6O7.C20H36N2O6.C18H34N4O5.C15H24N6O6S.C15H28N2O4.C14H16N2O4.C10H20N2O2.C10H18O5.C5H8O2.C2H6.H4N2.H2O/c1-32(2,3)45-30(42)35-17-14-24(15-18-35)36(31(43)46-33(4,5)6)19-16-26(39)20-34-28(40)27-13-12-25-21-37(27)29(41)38(25)44-22-23-10-8-7-9-11-23;1-31(2,3)44-29(40)35-17-14-23(15-18-35)36(30(41)45-32(4,5)6)19-16-26-33-34-27(43-26)25-13-12-24-20-37(25)28(39)38(24)42-21-22-10-8-7-9-11-22;1-24(2,3)37-22(33)28-12-9-16(10-13-28)29(23(34)38-25(4,5)6)14-11-19-26-27-20(36-19)18-8-7-17-15-30(18)21(32)31(17)35;1-8-26-16(23)11-14-22(18(25)28-20(5,6)7)15-9-12-21(13-10-15)17(24)27-19(2,3)4;1-17(2,3)26-15(24)21-10-7-13(8-11-21)22(12-9-14(23)20-19)16(25)27-18(4,5)6;22-15-20-9-11(21(15)27-28(23,24)25)1-2-12(20)14-19-18-13(26-14)5-8-17-10-3-6-16-7-4-10;1-5-20-13(18)6-9-16-12-7-10-17(11-8-12)14(19)21-15(2,3)4;17-13(18)12-7-6-11-8-15(12)14(19)16(11)20-9-10-4-2-1-3-5-10;1-10(2,3)14-9(13)12-6-4-8(11)5-7-12;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;1-3-5(6)7-4-2;2*1-2;/h7-11,24-25,27H,12-22H2,1-6H3,(H,34,40);7-11,23-25H,12-21H2,1-6H3;16-18,35H,7-15H2,1-6H3;15H,8-14H2,1-7H3;13H,7-12,19H2,1-6H3,(H,20,23);10-12,16-17H,1-9H2,(H,23,24,25);12,16H,5-11H2,1-4H3;1-5,11-12H,6-9H2,(H,17,18);8H,4-7,11H2,1-3H3;1-6H3;3H,1,4H2,2H3;1-2H3;1-2H2;1H2/t25-,27+;24-,25+;17-,18+;;;11-,12+;;11-,12+;;;;;;/m111..1.1....../s1/i;;;;;;;;;;;1D;;.

What are the key properties of tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate?

tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate has a molecular weight of 4187.11 g/mol, XLogP of 25.58, 50 rotatable bonds, 12 hydrogen bond donors, and 67 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 4-aminopiperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)amino]piperidine-1-carboxylate;tert-butyl 4-[(3-ethoxy-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(3-hydrazinyl-3-oxopropyl)-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl 4-[2-[5-[(2S,5R)-6-hydroxy-7-oxo-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]piperidine-1-carboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[3-oxo-4-[[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carbonyl]amino]butyl]amino]piperidine-1-carboxylate;tert-butyl 4-[(2-methylpropan-2-yl)oxycarbonyl-[2-[5-[(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octan-2-yl]-1,3,4-oxadiazol-2-yl]ethyl]amino]piperidine-1-carboxylate;deuterioethane;ethyl prop-2-enoate;hydrazine;(2S,5R)-7-oxo-6-phenylmethoxy-1,6-diazabicyclo[3.2.1]octane-2-carboxylic acid;[(2S,5R)-7-oxo-2-[5-[2-(piperidin-4-ylamino)ethyl]-1,3,4-oxadiazol-2-yl]-1,6-diazabicyclo[3.2.1]octan-6-yl] hydrogen sulfate;hydrate is sourced from PubChem (CID 159438971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).