N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine

C123H173F18IN16O19S — CID 164998322

IUPACN-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine
SMILESC.C.C.CC(=O)C(=O)Nc1cnc(CC(=O)OC(C)(C)C)c(C)c1.CC(C)(C)OC(=O)N1CCCC=C1C12CC(C(F)(F)F)(C1)C2.CC(C)(C)OC(=O)N1CCCC=C1OS(=O)(=O)C(F)(F)F.CCC(C)C1CCCCN1C(=O)C(=O)Nc1cnc(N)c(C)c1.Cc1cc(NC(=O)C(=O)N2CCCCC2C23CC(C(F)(F)F)(C2)C3)cnc1CC(=O)OC(C)(C)C.Cc1cc(NC(=O)C(=O)N2CCCCC2C23CC(C(F)(F)F)(C2)C3)cnc1N.FC(F)(F)C12CC(C3CCCCN3)(C1)C2.FC(F)(F)C12CC(I)(C1)C2
InChIInChI=1S/C25H32F3N3O4.C19H23F3N4O2.C17H26N4O2.C16H22F3NO2.C15H20N2O4.C11H16F3NO5S.C11H16F3N.C6H6F3I.3CH4/c1-15-9-16(11-29-17(15)10-19(32)35-22(2,3)4)30-20(33)21(34)31-8-6-5-7-18(31)23-12-24(13-23,14-23)25(26,27)28;1-11-6-12(7-24-14(11)23)25-15(27)16(28)26-5-3-2-4-13(26)17-8-18(9-17,10-17)19(20,21)22;1-4-11(2)14-7-5-6-8-21(14)17(23)16(22)20-13-9-12(3)15(18)19-10-13;1-13(2,3)22-12(21)20-7-5-4-6-11(20)14-8-15(9-14,10-14)16(17,18)19;1-9-6-11(17-14(20)10(2)18)8-16-12(9)7-13(19)21-15(3,4)5;1-10(2,3)19-9(16)15-7-5-4-6-8(15)20-21(17,18)11(12,13)14;12-11(13,14)10-5-9(6-10,7-10)8-3-1-2-4-15-8;7-6(8,9)4-1-5(10,2-4)3-4;;;/h9,11,18H,5-8,10,12-14H2,1-4H3,(H,30,33);6-7,13H,2-5,8-10H2,1H3,(H2,23,24)(H,25,27);9-11,14H,4-8H2,1-3H3,(H2,18,19)(H,20,22);6H,4-5,7-10H2,1-3H3;6,8H,7H2,1-5H3,(H,17,20);6H,4-5,7H2,1-3H3;8,15H,1-7H2;1-3H2;3*1H4
InChIKeyHWHWVSGRSIOLIQ-UHFFFAOYSA-N
MW2680.76 g/mol
LogP26.52
Rot. Bonds17

About N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine

N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine (PubChem CID 164998322) has the molecular formula C123H173F18IN16O19S and a molecular weight of 2680.76 g/mol. Its IUPAC name is N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine.

Molecular Properties

Compound NameN-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine
PubChem CID164998322
Molecular FormulaC123H173F18IN16O19S
Molecular Weight2680.76 g/mol
Exact Mass2679.15
IUPAC NameN-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine
SMILESC.C.C.CC(=O)C(=O)Nc1cnc(CC(=O)OC(C)(C)C)c(C)c1.CC(C)(C)OC(=O)N1CCCC=C1C12CC(C(F)(F)F)(C1)C2.CC(C)(C)OC(=O)N1CCCC=C1OS(=O)(=O)C(F)(F)F.CCC(C)C1CCCCN1C(=O)C(=O)Nc1cnc(N)c(C)c1.Cc1cc(NC(=O)C(=O)N2CCCCC2C23CC(C(F)(F)F)(C2)C3)cnc1CC(=O)OC(C)(C)C.Cc1cc(NC(=O)C(=O)N2CCCCC2C23CC(C(F)(F)F)(C2)C3)cnc1N.FC(F)(F)C12CC(C3CCCCN3)(C1)C2.FC(F)(F)C12CC(I)(C1)C2
InChIInChI=1S/C25H32F3N3O4.C19H23F3N4O2.C17H26N4O2.C16H22F3NO2.C15H20N2O4.C11H16F3NO5S.C11H16F3N.C6H6F3I.3CH4/c1-15-9-16(11-29-17(15)10-19(32)35-22(2,3)4)30-20(33)21(34)31-8-6-5-7-18(31)23-12-24(13-23,14-23)25(26,27)28;1-11-6-12(7-24-14(11)23)25-15(27)16(28)26-5-3-2-4-13(26)17-8-18(9-17,10-17)19(20,21)22;1-4-11(2)14-7-5-6-8-21(14)17(23)16(22)20-13-9-12(3)15(18)19-10-13;1-13(2,3)22-12(21)20-7-5-4-6-11(20)14-8-15(9-14,10-14)16(17,18)19;1-9-6-11(17-14(20)10(2)18)8-16-12(9)7-13(19)21-15(3,4)5;1-10(2,3)19-9(16)15-7-5-4-6-8(15)20-21(17,18)11(12,13)14;12-11(13,14)10-5-9(6-10,7-10)8-3-1-2-4-15-8;7-6(8,9)4-1-5(10,2-4)3-4;;;/h9,11,18H,5-8,10,12-14H2,1-4H3,(H,30,33);6-7,13H,2-5,8-10H2,1H3,(H2,23,24)(H,25,27);9-11,14H,4-8H2,1-3H3,(H2,18,19)(H,20,22);6H,4-5,7-10H2,1-3H3;6,8H,7H2,1-5H3,(H,17,20);6H,4-5,7H2,1-3H3;8,15H,1-7H2;1-3H2;3*1H4
InChIKeyHWHWVSGRSIOLIQ-UHFFFAOYSA-N
XLogP26.52
TPSA465.08 Ų
H-Bond Donors7
H-Bond Acceptors26
Rotatable Bonds17
Heavy Atoms178
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002680.76
LogP ≤ 526.52
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_1', 'substructure': 'N/A'}

Analyze N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine?
The IUPAC name of N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine (CID 164998322) is N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine.
What is the SMILES notation for N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine?
The canonical SMILES for N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine is C.C.C.CC(=O)C(=O)Nc1cnc(CC(=O)OC(C)(C)C)c(C)c1.CC(C)(C)OC(=O)N1CCCC=C1C12CC(C(F)(F)F)(C1)C2.CC(C)(C)OC(=O)N1CCCC=C1OS(=O)(=O)C(F)(F)F.CCC(C)C1CCCCN1C(=O)C(=O)Nc1cnc(N)c(C)c1.Cc1cc(NC(=O)C(=O)N2CCCCC2C23CC(C(F)(F)F)(C2)C3)cnc1CC(=O)OC(C)(C)C.Cc1cc(NC(=O)C(=O)N2CCCCC2C23CC(C(F)(F)F)(C2)C3)cnc1N.FC(F)(F)C12CC(C3CCCCN3)(C1)C2.FC(F)(F)C12CC(I)(C1)C2.
What is the InChIKey of N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine?
The InChIKey is HWHWVSGRSIOLIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32F3N3O4.C19H23F3N4O2.C17H26N4O2.C16H22F3NO2.C15H20N2O4.C11H16F3NO5S.C11H16F3N.C6H6F3I.3CH4/c1-15-9-16(11-29-17(15)10-19(32)35-22(2,3)4)30-20(33)21(34)31-8-6-5-7-18(31)23-12-24(13-23,14-23)25(26,27)28;1-11-6-12(7-24-14(11)23)25-15(27)16(28)26-5-3-2-4-13(26)17-8-18(9-17,10-17)19(20,21)22;1-4-11(2)14-7-5-6-8-21(14)17(23)16(22)20-13-9-12(3)15(18)19-10-13;1-13(2,3)22-12(21)20-7-5-4-6-11(20)14-8-15(9-14,10-14)16(17,18)19;1-9-6-11(17-14(20)10(2)18)8-16-12(9)7-13(19)21-15(3,4)5;1-10(2,3)19-9(16)15-7-5-4-6-8(15)20-21(17,18)11(12,13)14;12-11(13,14)10-5-9(6-10,7-10)8-3-1-2-4-15-8;7-6(8,9)4-1-5(10,2-4)3-4;;;/h9,11,18H,5-8,10,12-14H2,1-4H3,(H,30,33);6-7,13H,2-5,8-10H2,1H3,(H2,23,24)(H,25,27);9-11,14H,4-8H2,1-3H3,(H2,18,19)(H,20,22);6H,4-5,7-10H2,1-3H3;6,8H,7H2,1-5H3,(H,17,20);6H,4-5,7H2,1-3H3;8,15H,1-7H2;1-3H2;3*1H4.
What are the key properties of N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine?
N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine has a molecular weight of 2680.76 g/mol, XLogP of 26.52, 17 rotatable bonds, 7 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-5-methyl-3-pyridinyl)-2-(2-butan-2-ylpiperidin-1-yl)-2-oxoacetamide;N-(6-amino-5-methyl-3-pyridinyl)-2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetamide;tert-butyl 2-[3-methyl-5-(2-oxopropanoylamino)-2-pyridinyl]acetate;tert-butyl 2-[3-methyl-5-[[2-oxo-2-[2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidin-1-yl]acetyl]amino]-2-pyridinyl]acetate;tert-butyl 6-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]-3,4-dihydro-2H-pyridine-1-carboxylate;tert-butyl 6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate;1-iodo-3-(trifluoromethyl)bicyclo[1.1.1]pentane;methane;2-[3-(trifluoromethyl)-1-bicyclo[1.1.1]pentanyl]piperidine is sourced from PubChem (CID 164998322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).