(2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate

C160H210Br2Cl2FN27O27 — CID 158655599

IUPAC(2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate
SMILESCNC(=O)COC(=O)CCCC1CCN(c2cc(-c3ccccc3)ccn2)CC1.Cc1ccnc(N2CCC(CCC(=O)OCC(N)=O)CC2)c1.Cc1ccnc(N2CCC(CCCC(=O)OCC(N)=O)CC2)c1.NC(=O)COC(=O)CC1CCN(c2ccc(Br)cn2)CC1.NC(=O)COC(=O)CCC1CCN(c2ccc(Br)cn2)CC1.NC(=O)COC(=O)CCC1CCN(c2ccc(Cl)cn2)CC1.NC(=O)COC(=O)CCCC1CCN(c2cc(-c3ccccc3)ccn2)CC1.NC(=O)COC(=O)CCCC1CCN(c2ccc(Cl)cn2)CC1.NC(=O)COC(=O)CCCC1CCN(c2ncccc2-c2ccc(F)cc2)CC1
InChIInChI=1S/C23H29N3O3.C22H26FN3O3.C22H27N3O3.C17H25N3O3.C16H22ClN3O3.C16H23N3O3.C15H20BrN3O3.C15H20ClN3O3.C14H18BrN3O3/c1-24-22(27)17-29-23(28)9-5-6-18-11-14-26(15-12-18)21-16-20(10-13-25-21)19-7-3-2-4-8-19;23-18-8-6-17(7-9-18)19-4-2-12-25-22(19)26-13-10-16(11-14-26)3-1-5-21(28)29-15-20(24)27;23-20(26)16-28-22(27)8-4-5-17-10-13-25(14-11-17)21-15-19(9-12-24-21)18-6-2-1-3-7-18;1-13-5-8-19-16(11-13)20-9-6-14(7-10-20)3-2-4-17(22)23-12-15(18)21;17-13-4-5-15(19-10-13)20-8-6-12(7-9-20)2-1-3-16(22)23-11-14(18)21;1-12-4-7-18-15(10-12)19-8-5-13(6-9-19)2-3-16(21)22-11-14(17)20;2*16-12-2-3-14(18-9-12)19-7-5-11(6-8-19)1-4-15(21)22-10-13(17)20;15-11-1-2-13(17-8-11)18-5-3-10(4-6-18)7-14(20)21-9-12(16)19/h2-4,7-8,10,13,16,18H,5-6,9,11-12,14-15,17H2,1H3,(H,24,27);2,4,6-9,12,16H,1,3,5,10-11,13-15H2,(H2,24,27);1-3,6-7,9,12,15,17H,4-5,8,10-11,13-14,16H2,(H2,23,26);5,8,11,14H,2-4,6-7,9-10,12H2,1H3,(H2,18,21);4-5,10,12H,1-3,6-9,11H2,(H2,18,21);4,7,10,13H,2-3,5-6,8-9,11H2,1H3,(H2,17,20);2*2-3,9,11H,1,4-8,10H2,(H2,17,20);1-2,8,10H,3-7,9H2,(H2,16,19)
InChIKeyICCCGYBSIJOSSU-UHFFFAOYSA-N
MW3193.31 g/mol
LogP20.37
Rot. Bonds61

About (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate

(2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate (PubChem CID 158655599) has the molecular formula C160H210Br2Cl2FN27O27 and a molecular weight of 3193.31 g/mol. Its IUPAC name is (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate.

Molecular Properties

Compound Name(2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate
PubChem CID158655599
Molecular FormulaC160H210Br2Cl2FN27O27
Molecular Weight3193.31 g/mol
Exact Mass3188.36
IUPAC Name(2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate
SMILESCNC(=O)COC(=O)CCCC1CCN(c2cc(-c3ccccc3)ccn2)CC1.Cc1ccnc(N2CCC(CCC(=O)OCC(N)=O)CC2)c1.Cc1ccnc(N2CCC(CCCC(=O)OCC(N)=O)CC2)c1.NC(=O)COC(=O)CC1CCN(c2ccc(Br)cn2)CC1.NC(=O)COC(=O)CCC1CCN(c2ccc(Br)cn2)CC1.NC(=O)COC(=O)CCC1CCN(c2ccc(Cl)cn2)CC1.NC(=O)COC(=O)CCCC1CCN(c2cc(-c3ccccc3)ccn2)CC1.NC(=O)COC(=O)CCCC1CCN(c2ccc(Cl)cn2)CC1.NC(=O)COC(=O)CCCC1CCN(c2ncccc2-c2ccc(F)cc2)CC1
InChIInChI=1S/C23H29N3O3.C22H26FN3O3.C22H27N3O3.C17H25N3O3.C16H22ClN3O3.C16H23N3O3.C15H20BrN3O3.C15H20ClN3O3.C14H18BrN3O3/c1-24-22(27)17-29-23(28)9-5-6-18-11-14-26(15-12-18)21-16-20(10-13-25-21)19-7-3-2-4-8-19;23-18-8-6-17(7-9-18)19-4-2-12-25-22(19)26-13-10-16(11-14-26)3-1-5-21(28)29-15-20(24)27;23-20(26)16-28-22(27)8-4-5-17-10-13-25(14-11-17)21-15-19(9-12-24-21)18-6-2-1-3-7-18;1-13-5-8-19-16(11-13)20-9-6-14(7-10-20)3-2-4-17(22)23-12-15(18)21;17-13-4-5-15(19-10-13)20-8-6-12(7-9-20)2-1-3-16(22)23-11-14(18)21;1-12-4-7-18-15(10-12)19-8-5-13(6-9-19)2-3-16(21)22-11-14(17)20;2*16-12-2-3-14(18-9-12)19-7-5-11(6-8-19)1-4-15(21)22-10-13(17)20;15-11-1-2-13(17-8-11)18-5-3-10(4-6-18)7-14(20)21-9-12(16)19/h2-4,7-8,10,13,16,18H,5-6,9,11-12,14-15,17H2,1H3,(H,24,27);2,4,6-9,12,16H,1,3,5,10-11,13-15H2,(H2,24,27);1-3,6-7,9,12,15,17H,4-5,8,10-11,13-14,16H2,(H2,23,26);5,8,11,14H,2-4,6-7,9-10,12H2,1H3,(H2,18,21);4-5,10,12H,1-3,6-9,11H2,(H2,18,21);4,7,10,13H,2-3,5-6,8-9,11H2,1H3,(H2,17,20);2*2-3,9,11H,1,4-8,10H2,(H2,17,20);1-2,8,10H,3-7,9H2,(H2,16,19)
InChIKeyICCCGYBSIJOSSU-UHFFFAOYSA-N
XLogP20.37
TPSA755.69 Ų
H-Bond Donors9
H-Bond Acceptors45
Rotatable Bonds61
Heavy Atoms219
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003193.31
LogP ≤ 520.37
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1045

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Analyze (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate with MolForge

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Frequently Asked Questions

What is the IUPAC name of (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate?
The IUPAC name of (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate (CID 158655599) is (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate.
What is the SMILES notation for (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate?
The canonical SMILES for (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate is CNC(=O)COC(=O)CCCC1CCN(c2cc(-c3ccccc3)ccn2)CC1.Cc1ccnc(N2CCC(CCC(=O)OCC(N)=O)CC2)c1.Cc1ccnc(N2CCC(CCCC(=O)OCC(N)=O)CC2)c1.NC(=O)COC(=O)CC1CCN(c2ccc(Br)cn2)CC1.NC(=O)COC(=O)CCC1CCN(c2ccc(Br)cn2)CC1.NC(=O)COC(=O)CCC1CCN(c2ccc(Cl)cn2)CC1.NC(=O)COC(=O)CCCC1CCN(c2cc(-c3ccccc3)ccn2)CC1.NC(=O)COC(=O)CCCC1CCN(c2ccc(Cl)cn2)CC1.NC(=O)COC(=O)CCCC1CCN(c2ncccc2-c2ccc(F)cc2)CC1.
What is the InChIKey of (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate?
The InChIKey is ICCCGYBSIJOSSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O3.C22H26FN3O3.C22H27N3O3.C17H25N3O3.C16H22ClN3O3.C16H23N3O3.C15H20BrN3O3.C15H20ClN3O3.C14H18BrN3O3/c1-24-22(27)17-29-23(28)9-5-6-18-11-14-26(15-12-18)21-16-20(10-13-25-21)19-7-3-2-4-8-19;23-18-8-6-17(7-9-18)19-4-2-12-25-22(19)26-13-10-16(11-14-26)3-1-5-21(28)29-15-20(24)27;23-20(26)16-28-22(27)8-4-5-17-10-13-25(14-11-17)21-15-19(9-12-24-21)18-6-2-1-3-7-18;1-13-5-8-19-16(11-13)20-9-6-14(7-10-20)3-2-4-17(22)23-12-15(18)21;17-13-4-5-15(19-10-13)20-8-6-12(7-9-20)2-1-3-16(22)23-11-14(18)21;1-12-4-7-18-15(10-12)19-8-5-13(6-9-19)2-3-16(21)22-11-14(17)20;2*16-12-2-3-14(18-9-12)19-7-5-11(6-8-19)1-4-15(21)22-10-13(17)20;15-11-1-2-13(17-8-11)18-5-3-10(4-6-18)7-14(20)21-9-12(16)19/h2-4,7-8,10,13,16,18H,5-6,9,11-12,14-15,17H2,1H3,(H,24,27);2,4,6-9,12,16H,1,3,5,10-11,13-15H2,(H2,24,27);1-3,6-7,9,12,15,17H,4-5,8,10-11,13-14,16H2,(H2,23,26);5,8,11,14H,2-4,6-7,9-10,12H2,1H3,(H2,18,21);4-5,10,12H,1-3,6-9,11H2,(H2,18,21);4,7,10,13H,2-3,5-6,8-9,11H2,1H3,(H2,17,20);2*2-3,9,11H,1,4-8,10H2,(H2,17,20);1-2,8,10H,3-7,9H2,(H2,16,19).
What are the key properties of (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate?
(2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate has a molecular weight of 3193.31 g/mol, XLogP of 20.37, 61 rotatable bonds, 9 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-2-oxoethyl) 2-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]acetate;(2-amino-2-oxoethyl) 3-[1-(5-bromo-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(5-chloro-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-[3-(4-fluorophenyl)-2-pyridinyl]piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 4-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]butanoate;(2-amino-2-oxoethyl) 3-[1-(4-methyl-2-pyridinyl)piperidin-4-yl]propanoate;(2-amino-2-oxoethyl) 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate;[2-(methylamino)-2-oxoethyl] 4-[1-(4-phenyl-2-pyridinyl)piperidin-4-yl]butanoate is sourced from PubChem (CID 158655599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).