benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile

C183H242ClN37O26S3Si5 — CID 167563214

About benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile

benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile (PubChem CID 167563214) has the molecular formula C183H242ClN37O26S3Si5 and a molecular weight of 3648.27 g/mol. Its IUPAC name is benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile.

Molecular Properties

• Compound Name: benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile
• PubChem CID: 167563214
• Molecular Formula: C183H242ClN37O26S3Si5
• Molecular Weight: 3648.27 g/mol
• Exact Mass: 3644.64
• IUPAC Name: benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile
• SMILES: CCOC(=O)c1cnc2c(ccn2COCC[Si](C)(C)C)c1Cl.CCOC(=O)c1cnc2c(ccn2COCC[Si](C)(C)C)c1N[C@@H]1C[C@H](C)CN(C(=O)OCc2ccccc2)C1.C[C@@H]1CNC[C@H](Nc2c(-c3nncs3)cnc3[nH]ccc23)C1.C[C@H]1C[C@@H](N)CN(C(=O)OCc2ccccc2)C1.C[C@H]1C[C@@H](Nc2c(-c3nncs3)cnc3[nH]ccc23)CN(C(=O)CC#N)C1.C[C@H]1C[C@@H](Nc2c(-c3nncs3)cnc3c2ccn3COCC[Si](C)(C)C)CN(C(=O)OCc2ccccc2)C1.C[C@H]1C[C@@H](Nc2c(C(=O)NCC=O)cnc3c2ccn3COCC[Si](C)(C)C)CN(C(=O)OCc2ccccc2)C1.C[C@H]1C[C@@H](Nc2c(C(=O)O)cnc3c2ccn3COCC[Si](C)(C)C)CN(C(=O)OCc2ccccc2)C1.N#CCC(=O)O
• InChI: InChI=1S/C30H41N5O5Si.C30H42N4O5Si.C29H38N6O3SSi.C28H38N4O5Si.C18H19N7OS.C16H23ClN2O3Si.C15H18N6S.C14H20N2O2.C3H3NO2/c1-22-16-24(19-35(18-22)30(38)40-20-23-8-6-5-7-9-23)33-27-25-10-12-34(21-39-14-15-41(2,3)4)28(25)32-17-26(27)29(37)31-11-13-36;1-6-38-29(35)26-17-31-28-25(12-13-33(28)21-37-14-15-40(3,4)5)27(26)32-24-16-22(2)18-34(19-24)30(36)39-20-23-10-8-7-9-11-23;1-21-14-23(17-35(16-21)29(36)38-18-22-8-6-5-7-9-22)32-26-24-10-11-34(20-37-12-13-40(2,3)4)27(24)30-15-25(26)28-33-31-19-39-28;1-20-14-22(17-32(16-20)28(35)37-18-21-8-6-5-7-9-21)30-25-23-10-11-31(19-36-12-13-38(2,3)4)26(23)29-15-24(25)27(33)34;1-11-6-12(9-25(8-11)15(26)2-4-19)23-16-13-3-5-20-17(13)21-7-14(16)18-24-22-10-27-18;1-5-22-16(20)13-10-18-15-12(14(13)17)6-7-19(15)11-21-8-9-23(2,3)4;1-9-4-10(6-16-5-9)20-13-11-2-3-17-14(11)18-7-12(13)15-21-19-8-22-15;1-11-7-13(15)9-16(8-11)14(17)18-10-12-5-3-2-4-6-12;4-2-1-3(5)6/h5-10,12-13,17,22,24H,11,14-16,18-21H2,1-4H3,(H,31,37)(H,32,33);7-13,17,22,24H,6,14-16,18-21H2,1-5H3,(H,31,32);5-11,15,19,21,23H,12-14,16-18,20H2,1-4H3,(H,30,32);5-11,15,20,22H,12-14,16-19H2,1-4H3,(H,29,30)(H,33,34);3,5,7,10-12H,2,6,8-9H2,1H3,(H2,20,21,23);6-7,10H,5,8-9,11H2,1-4H3;2-3,7-10,16H,4-6H2,1H3,(H2,17,18,20);2-6,11,13H,7-10,15H2,1H3;1H2,(H,5,6)/t2*22-,24+;21-,23+;20-,22+;11-,12+;;9-,10+;11-,13+;/m00000.00./s1
• InChIKey: DXYWRLBHLFHYFM-LRVZEEGCSA-N
• XLogP: 33.84
• TPSA: 769.14 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 55
• Rotatable Bonds: 60
• Heavy Atoms: 255
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3648.27
LogP ≤ 5	33.84
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	55

Frequently Asked Questions

What is the IUPAC name of benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile?

The IUPAC name of benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile (CID 167563214) is benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile.

What is the SMILES notation for benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile?

The canonical SMILES for benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile is CCOC(=O)c1cnc2c(ccn2COCC[Si](C)(C)C)c1Cl.CCOC(=O)c1cnc2c(ccn2COCC[Si](C)(C)C)c1N[C@@H]1C[C@H](C)CN(C(=O)OCc2ccccc2)C1.C[C@@H]1CNC[C@H](Nc2c(-c3nncs3)cnc3[nH]ccc23)C1.C[C@H]1C[C@@H](N)CN(C(=O)OCc2ccccc2)C1.C[C@H]1C[C@@H](Nc2c(-c3nncs3)cnc3[nH]ccc23)CN(C(=O)CC#N)C1.C[C@H]1C[C@@H](Nc2c(-c3nncs3)cnc3c2ccn3COCC[Si](C)(C)C)CN(C(=O)OCc2ccccc2)C1.C[C@H]1C[C@@H](Nc2c(C(=O)NCC=O)cnc3c2ccn3COCC[Si](C)(C)C)CN(C(=O)OCc2ccccc2)C1.C[C@H]1C[C@@H](Nc2c(C(=O)O)cnc3c2ccn3COCC[Si](C)(C)C)CN(C(=O)OCc2ccccc2)C1.N#CCC(=O)O.

What is the InChIKey of benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile?

The InChIKey is DXYWRLBHLFHYFM-LRVZEEGCSA-N. The full InChI is InChI=1S/C30H41N5O5Si.C30H42N4O5Si.C29H38N6O3SSi.C28H38N4O5Si.C18H19N7OS.C16H23ClN2O3Si.C15H18N6S.C14H20N2O2.C3H3NO2/c1-22-16-24(19-35(18-22)30(38)40-20-23-8-6-5-7-9-23)33-27-25-10-12-34(21-39-14-15-41(2,3)4)28(25)32-17-26(27)29(37)31-11-13-36;1-6-38-29(35)26-17-31-28-25(12-13-33(28)21-37-14-15-40(3,4)5)27(26)32-24-16-22(2)18-34(19-24)30(36)39-20-23-10-8-7-9-11-23;1-21-14-23(17-35(16-21)29(36)38-18-22-8-6-5-7-9-22)32-26-24-10-11-34(20-37-12-13-40(2,3)4)27(24)30-15-25(26)28-33-31-19-39-28;1-20-14-22(17-32(16-20)28(35)37-18-21-8-6-5-7-9-21)30-25-23-10-11-31(19-36-12-13-38(2,3)4)26(23)29-15-24(25)27(33)34;1-11-6-12(9-25(8-11)15(26)2-4-19)23-16-13-3-5-20-17(13)21-7-14(16)18-24-22-10-27-18;1-5-22-16(20)13-10-18-15-12(14(13)17)6-7-19(15)11-21-8-9-23(2,3)4;1-9-4-10(6-16-5-9)20-13-11-2-3-17-14(11)18-7-12(13)15-21-19-8-22-15;1-11-7-13(15)9-16(8-11)14(17)18-10-12-5-3-2-4-6-12;4-2-1-3(5)6/h5-10,12-13,17,22,24H,11,14-16,18-21H2,1-4H3,(H,31,37)(H,32,33);7-13,17,22,24H,6,14-16,18-21H2,1-5H3,(H,31,32);5-11,15,19,21,23H,12-14,16-18,20H2,1-4H3,(H,30,32);5-11,15,20,22H,12-14,16-19H2,1-4H3,(H,29,30)(H,33,34);3,5,7,10-12H,2,6,8-9H2,1H3,(H2,20,21,23);6-7,10H,5,8-9,11H2,1-4H3;2-3,7-10,16H,4-6H2,1H3,(H2,17,18,20);2-6,11,13H,7-10,15H2,1H3;1H2,(H,5,6)/t2*22-,24+;21-,23+;20-,22+;11-,12+;;9-,10+;11-,13+;/m00000.00./s1.

What are the key properties of benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile?

benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile has a molecular weight of 3648.27 g/mol, XLogP of 33.84, 60 rotatable bonds, 13 hydrogen bond donors, and 55 hydrogen bond acceptors.

Where does this data come from?

All data for benzyl (3R,5S)-3-amino-5-methylpiperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(2-oxoethylcarbamoyl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;benzyl (3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-4-yl]amino]piperidine-1-carboxylate;2-cyanoacetic acid;ethyl 4-chloro-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;ethyl 4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylate;4-[[(3R,5S)-5-methyl-1-phenylmethoxycarbonylpiperidin-3-yl]amino]-1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridine-5-carboxylic acid;N-[(3R,5S)-5-methylpiperidin-3-yl]-5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-amine;3-[(3S,5R)-3-methyl-5-[[5-(1,3,4-thiadiazol-2-yl)-1H-pyrrolo[2,3-b]pyridin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile is sourced from PubChem (CID 167563214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).