N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride

C149H183BrClN31O23S3 — CID 160540900

IUPACN-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride
SMILESCCOC(=O)C1CCC(C)N(c2ccc([N+](=O)[O-])nc2)C1.CCOC(=O)C1CCCN(c2ccc(N)nc2)C1.CCOC(=O)C1CCCN(c2ccc(NC(=O)Cc3cccc(C)c3)nc2)C1.CCOC(=O)C1CCCNC1.Cc1cccc(CC(=O)Nc2ccc(N3CCCC(C(=O)O)C3)cn2)c1.Cc1cccc(CC(=O)Nc2ccc(N3CCCC(c4nnc(CC(=O)Cc5ccccn5)s4)C3)cn2)c1.Cc1cccc(CC(=O)Nc2ccc(N3CCCC(c4nnc(N)s4)C3)cn2)c1.Cc1cccc(CC(=O)O)c1.Cl.NNC(N)=S.O=C(O)Cc1ccccn1.O=[N+]([O-])c1ccc(Br)cn1
InChIInChI=1S/C29H30N6O2S.C22H27N3O3.C21H24N6OS.C20H23N3O3.C14H19N3O4.C13H19N3O2.C9H10O2.C8H15NO2.C7H7NO2.C5H3BrN2O2.CH5N3S.ClH/c1-20-6-4-7-21(14-20)15-27(37)32-26-11-10-24(18-31-26)35-13-5-8-22(19-35)29-34-33-28(38-29)17-25(36)16-23-9-2-3-12-30-23;1-3-28-22(27)18-8-5-11-25(15-18)19-9-10-20(23-14-19)24-21(26)13-17-7-4-6-16(2)12-17;1-14-4-2-5-15(10-14)11-19(28)24-18-8-7-17(12-23-18)27-9-3-6-16(13-27)20-25-26-21(22)29-20;1-14-4-2-5-15(10-14)11-19(24)22-18-8-7-17(12-21-18)23-9-3-6-16(13-23)20(25)26;1-3-21-14(18)11-5-4-10(2)16(9-11)12-6-7-13(15-8-12)17(19)20;1-2-18-13(17)10-4-3-7-16(9-10)11-5-6-12(14)15-8-11;1-7-3-2-4-8(5-7)6-9(10)11;1-2-11-8(10)7-4-3-5-9-6-7;9-7(10)5-6-3-1-2-4-8-6;6-4-1-2-5(7-3-4)8(9)10;2-1(5)4-3;/h2-4,6-7,9-12,14,18,22H,5,8,13,15-17,19H2,1H3,(H,31,32,37);4,6-7,9-10,12,14,18H,3,5,8,11,13,15H2,1-2H3,(H,23,24,26);2,4-5,7-8,10,12,16H,3,6,9,11,13H2,1H3,(H2,22,26)(H,23,24,28);2,4-5,7-8,10,12,16H,3,6,9,11,13H2,1H3,(H,25,26)(H,21,22,24);6-8,10-11H,3-5,9H2,1-2H3;5-6,8,10H,2-4,7,9H2,1H3,(H2,14,15);2-5H,6H2,1H3,(H,10,11);7,9H,2-6H2,1H3;1-4H,5H2,(H,9,10);1-3H;3H2,(H3,2,4,5);1H
InChIKeyQCHYAVIIDUVWOI-UHFFFAOYSA-N
MW2987.85 g/mol
LogP21.52
Rot. Bonds39

About N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride

N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride (PubChem CID 160540900) has the molecular formula C149H183BrClN31O23S3 and a molecular weight of 2987.85 g/mol. Its IUPAC name is N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride.

Molecular Properties

Compound NameN-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride
PubChem CID160540900
Molecular FormulaC149H183BrClN31O23S3
Molecular Weight2987.85 g/mol
Exact Mass2984.21
IUPAC NameN-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride
SMILESCCOC(=O)C1CCC(C)N(c2ccc([N+](=O)[O-])nc2)C1.CCOC(=O)C1CCCN(c2ccc(N)nc2)C1.CCOC(=O)C1CCCN(c2ccc(NC(=O)Cc3cccc(C)c3)nc2)C1.CCOC(=O)C1CCCNC1.Cc1cccc(CC(=O)Nc2ccc(N3CCCC(C(=O)O)C3)cn2)c1.Cc1cccc(CC(=O)Nc2ccc(N3CCCC(c4nnc(CC(=O)Cc5ccccn5)s4)C3)cn2)c1.Cc1cccc(CC(=O)Nc2ccc(N3CCCC(c4nnc(N)s4)C3)cn2)c1.Cc1cccc(CC(=O)O)c1.Cl.NNC(N)=S.O=C(O)Cc1ccccn1.O=[N+]([O-])c1ccc(Br)cn1
InChIInChI=1S/C29H30N6O2S.C22H27N3O3.C21H24N6OS.C20H23N3O3.C14H19N3O4.C13H19N3O2.C9H10O2.C8H15NO2.C7H7NO2.C5H3BrN2O2.CH5N3S.ClH/c1-20-6-4-7-21(14-20)15-27(37)32-26-11-10-24(18-31-26)35-13-5-8-22(19-35)29-34-33-28(38-29)17-25(36)16-23-9-2-3-12-30-23;1-3-28-22(27)18-8-5-11-25(15-18)19-9-10-20(23-14-19)24-21(26)13-17-7-4-6-16(2)12-17;1-14-4-2-5-15(10-14)11-19(28)24-18-8-7-17(12-23-18)27-9-3-6-16(13-27)20-25-26-21(22)29-20;1-14-4-2-5-15(10-14)11-19(24)22-18-8-7-17(12-21-18)23-9-3-6-16(13-23)20(25)26;1-3-21-14(18)11-5-4-10(2)16(9-11)12-6-7-13(15-8-12)17(19)20;1-2-18-13(17)10-4-3-7-16(9-10)11-5-6-12(14)15-8-11;1-7-3-2-4-8(5-7)6-9(10)11;1-2-11-8(10)7-4-3-5-9-6-7;9-7(10)5-6-3-1-2-4-8-6;6-4-1-2-5(7-3-4)8(9)10;2-1(5)4-3;/h2-4,6-7,9-12,14,18,22H,5,8,13,15-17,19H2,1H3,(H,31,32,37);4,6-7,9-10,12,14,18H,3,5,8,11,13,15H2,1-2H3,(H,23,24,26);2,4-5,7-8,10,12,16H,3,6,9,11,13H2,1H3,(H2,22,26)(H,23,24,28);2,4-5,7-8,10,12,16H,3,6,9,11,13H2,1H3,(H,25,26)(H,21,22,24);6-8,10-11H,3-5,9H2,1-2H3;5-6,8,10H,2-4,7,9H2,1H3,(H2,14,15);2-5H,6H2,1H3,(H,10,11);7,9H,2-6H2,1H3;1-4H,5H2,(H,9,10);1-3H;3H2,(H3,2,4,5);1H
InChIKeyQCHYAVIIDUVWOI-UHFFFAOYSA-N
XLogP21.52
TPSA752.00 Ų
H-Bond Donors13
H-Bond Acceptors46
Rotatable Bonds39
Heavy Atoms208
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002987.85
LogP ≤ 521.52
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1046

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride?
The IUPAC name of N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride (CID 160540900) is N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride.
What is the SMILES notation for N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride?
The canonical SMILES for N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride is CCOC(=O)C1CCC(C)N(c2ccc([N+](=O)[O-])nc2)C1.CCOC(=O)C1CCCN(c2ccc(N)nc2)C1.CCOC(=O)C1CCCN(c2ccc(NC(=O)Cc3cccc(C)c3)nc2)C1.CCOC(=O)C1CCCNC1.Cc1cccc(CC(=O)Nc2ccc(N3CCCC(C(=O)O)C3)cn2)c1.Cc1cccc(CC(=O)Nc2ccc(N3CCCC(c4nnc(CC(=O)Cc5ccccn5)s4)C3)cn2)c1.Cc1cccc(CC(=O)Nc2ccc(N3CCCC(c4nnc(N)s4)C3)cn2)c1.Cc1cccc(CC(=O)O)c1.Cl.NNC(N)=S.O=C(O)Cc1ccccn1.O=[N+]([O-])c1ccc(Br)cn1.
What is the InChIKey of N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride?
The InChIKey is QCHYAVIIDUVWOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30N6O2S.C22H27N3O3.C21H24N6OS.C20H23N3O3.C14H19N3O4.C13H19N3O2.C9H10O2.C8H15NO2.C7H7NO2.C5H3BrN2O2.CH5N3S.ClH/c1-20-6-4-7-21(14-20)15-27(37)32-26-11-10-24(18-31-26)35-13-5-8-22(19-35)29-34-33-28(38-29)17-25(36)16-23-9-2-3-12-30-23;1-3-28-22(27)18-8-5-11-25(15-18)19-9-10-20(23-14-19)24-21(26)13-17-7-4-6-16(2)12-17;1-14-4-2-5-15(10-14)11-19(28)24-18-8-7-17(12-23-18)27-9-3-6-16(13-27)20-25-26-21(22)29-20;1-14-4-2-5-15(10-14)11-19(24)22-18-8-7-17(12-21-18)23-9-3-6-16(13-23)20(25)26;1-3-21-14(18)11-5-4-10(2)16(9-11)12-6-7-13(15-8-12)17(19)20;1-2-18-13(17)10-4-3-7-16(9-10)11-5-6-12(14)15-8-11;1-7-3-2-4-8(5-7)6-9(10)11;1-2-11-8(10)7-4-3-5-9-6-7;9-7(10)5-6-3-1-2-4-8-6;6-4-1-2-5(7-3-4)8(9)10;2-1(5)4-3;/h2-4,6-7,9-12,14,18,22H,5,8,13,15-17,19H2,1H3,(H,31,32,37);4,6-7,9-10,12,14,18H,3,5,8,11,13,15H2,1-2H3,(H,23,24,26);2,4-5,7-8,10,12,16H,3,6,9,11,13H2,1H3,(H2,22,26)(H,23,24,28);2,4-5,7-8,10,12,16H,3,6,9,11,13H2,1H3,(H,25,26)(H,21,22,24);6-8,10-11H,3-5,9H2,1-2H3;5-6,8,10H,2-4,7,9H2,1H3,(H2,14,15);2-5H,6H2,1H3,(H,10,11);7,9H,2-6H2,1H3;1-4H,5H2,(H,9,10);1-3H;3H2,(H3,2,4,5);1H.
What are the key properties of N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride?
N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride has a molecular weight of 2987.85 g/mol, XLogP of 21.52, 39 rotatable bonds, 13 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[3-(5-amino-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-2-pyridinyl]-2-(3-methylphenyl)acetamide;aminothiourea;5-bromo-2-nitropyridine;ethyl 1-(6-amino-3-pyridinyl)piperidine-3-carboxylate;ethyl 6-methyl-1-(6-nitro-3-pyridinyl)piperidine-3-carboxylate;ethyl 1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylate;ethyl piperidine-3-carboxylate;2-(3-methylphenyl)acetic acid;1-[6-[[2-(3-methylphenyl)acetyl]amino]-3-pyridinyl]piperidine-3-carboxylic acid;2-(3-methylphenyl)-N-[5-[3-[5-(2-oxo-3-pyridin-2-ylpropyl)-1,3,4-thiadiazol-2-yl]piperidin-1-yl]-2-pyridinyl]acetamide;2-pyridin-2-ylacetic acid;hydrochloride is sourced from PubChem (CID 160540900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).