2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid

C312H433N31O40 — CID 162189264

IUPAC2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid
SMILESC.C.C.C.C.C.CC(C)(C)OC(=O)CCC(C)(CCN)C(=O)O.CC(C)(C)OC(=O)N1CCC[C@@](Cc2ccccc2)(C(=O)O)C1.CC(C)(C)OC(=O)NC(Cc1ccc2ccccc2c1)C(=O)O.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCN(C(=O)CCCCCN)CC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCN(C(=O)CCCCCNC(=O)OC(C)(C)C)CC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCN(C(=O)OC(C)(C)C)CC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCNCC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)OC(C)(C)C)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(N)Cc2ccc3ccccc3c2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCNC1
InChIInChI=1S/C46H63N5O6.C41H55N5O4.C40H52N4O5.C35H44N4O3.C33H41N3O4.C28H33N3O2.C20H30N2O3.C18H25NO4.C18H21NO4.C15H22N2O.C12H23NO4.6CH4/c1-6-47-42(55)46(32-34-16-9-7-10-17-34)23-15-27-51(33-46)40(53)38(31-35-21-22-36-18-12-13-19-37(36)30-35)49-41(54)45(5)24-28-50(29-25-45)39(52)20-11-8-14-26-48-43(56)57-44(2,3)4;1-3-43-39(50)41(29-31-13-6-4-7-14-31)20-12-24-46(30-41)37(48)35(28-32-18-19-33-15-9-10-16-34(33)27-32)44-38(49)40(2)21-25-45(26-22-40)36(47)17-8-5-11-23-42;1-6-41-36(47)40(27-29-13-8-7-9-14-29)19-12-22-44(28-40)34(45)33(26-30-17-18-31-15-10-11-16-32(31)25-30)42-35(46)39(5)20-23-43(24-21-39)37(48)49-38(2,3)4;1-3-37-33(42)35(24-26-10-5-4-6-11-26)16-9-21-39(25-35)31(40)30(38-32(41)34(2)17-19-36-20-18-34)23-27-14-15-28-12-7-8-13-29(28)22-27;1-5-34-30(38)33(22-24-12-7-6-8-13-24)18-11-19-36(23-33)29(37)28(35-31(39)40-32(2,3)4)21-25-16-17-26-14-9-10-15-27(26)20-25;1-2-30-27(33)28(19-21-9-4-3-5-10-21)15-8-16-31(20-28)26(32)25(29)18-22-13-14-23-11-6-7-12-24(23)17-22;1-5-21-17(23)20(14-16-10-7-6-8-11-16)12-9-13-22(15-20)18(24)25-19(2,3)4;1-17(2,3)23-16(22)19-11-7-10-18(13-19,15(20)21)12-14-8-5-4-6-9-14;1-18(2,3)23-17(22)19-15(16(20)21)11-12-8-9-13-6-4-5-7-14(13)10-12;1-2-17-14(18)15(9-6-10-16-12-15)11-13-7-4-3-5-8-13;1-11(2,3)17-9(14)5-6-12(4,7-8-13)10(15)16;;;;;;/h7,9-10,12-13,16-19,21-22,30,38H,6,8,11,14-15,20,23-29,31-33H2,1-5H3,(H,47,55)(H,48,56)(H,49,54);4,6-7,9-10,13-16,18-19,27,35H,3,5,8,11-12,17,20-26,28-30,42H2,1-2H3,(H,43,50)(H,44,49);7-11,13-18,25,33H,6,12,19-24,26-28H2,1-5H3,(H,41,47)(H,42,46);4-8,10-15,22,30,36H,3,9,16-21,23-25H2,1-2H3,(H,37,42)(H,38,41);6-10,12-17,20,28H,5,11,18-19,21-23H2,1-4H3,(H,34,38)(H,35,39);3-7,9-14,17,25H,2,8,15-16,18-20,29H2,1H3,(H,30,33);6-8,10-11H,5,9,12-15H2,1-4H3,(H,21,23);4-6,8-9H,7,10-13H2,1-3H3,(H,20,21);4-10,15H,11H2,1-3H3,(H,19,22)(H,20,21);3-5,7-8,16H,2,6,9-12H2,1H3,(H,17,18);5-8,13H2,1-4H3,(H,15,16);6*1H4/t38?,46-;35?,41-;33?,40-;30?,35-;28?,33-;25?,28-;20-;18-;;15-;;;;;;;/m00000000.0......./s1
InChIKeyZQBRJJFWMVZFLR-WHRCWZGJSA-N
MW5258.07 g/mol
LogP47.84
Rot. Bonds83

About 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid

2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid (PubChem CID 162189264) has the molecular formula C312H433N31O40 and a molecular weight of 5258.07 g/mol. Its IUPAC name is 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid.

Molecular Properties

Compound Name2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid
PubChem CID162189264
Molecular FormulaC312H433N31O40
Molecular Weight5258.07 g/mol
Exact Mass5254.28
IUPAC Name2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid
SMILESC.C.C.C.C.C.CC(C)(C)OC(=O)CCC(C)(CCN)C(=O)O.CC(C)(C)OC(=O)N1CCC[C@@](Cc2ccccc2)(C(=O)O)C1.CC(C)(C)OC(=O)NC(Cc1ccc2ccccc2c1)C(=O)O.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCN(C(=O)CCCCCN)CC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCN(C(=O)CCCCCNC(=O)OC(C)(C)C)CC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCN(C(=O)OC(C)(C)C)CC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCNCC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)OC(C)(C)C)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(N)Cc2ccc3ccccc3c2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCNC1
InChIInChI=1S/C46H63N5O6.C41H55N5O4.C40H52N4O5.C35H44N4O3.C33H41N3O4.C28H33N3O2.C20H30N2O3.C18H25NO4.C18H21NO4.C15H22N2O.C12H23NO4.6CH4/c1-6-47-42(55)46(32-34-16-9-7-10-17-34)23-15-27-51(33-46)40(53)38(31-35-21-22-36-18-12-13-19-37(36)30-35)49-41(54)45(5)24-28-50(29-25-45)39(52)20-11-8-14-26-48-43(56)57-44(2,3)4;1-3-43-39(50)41(29-31-13-6-4-7-14-31)20-12-24-46(30-41)37(48)35(28-32-18-19-33-15-9-10-16-34(33)27-32)44-38(49)40(2)21-25-45(26-22-40)36(47)17-8-5-11-23-42;1-6-41-36(47)40(27-29-13-8-7-9-14-29)19-12-22-44(28-40)34(45)33(26-30-17-18-31-15-10-11-16-32(31)25-30)42-35(46)39(5)20-23-43(24-21-39)37(48)49-38(2,3)4;1-3-37-33(42)35(24-26-10-5-4-6-11-26)16-9-21-39(25-35)31(40)30(38-32(41)34(2)17-19-36-20-18-34)23-27-14-15-28-12-7-8-13-29(28)22-27;1-5-34-30(38)33(22-24-12-7-6-8-13-24)18-11-19-36(23-33)29(37)28(35-31(39)40-32(2,3)4)21-25-16-17-26-14-9-10-15-27(26)20-25;1-2-30-27(33)28(19-21-9-4-3-5-10-21)15-8-16-31(20-28)26(32)25(29)18-22-13-14-23-11-6-7-12-24(23)17-22;1-5-21-17(23)20(14-16-10-7-6-8-11-16)12-9-13-22(15-20)18(24)25-19(2,3)4;1-17(2,3)23-16(22)19-11-7-10-18(13-19,15(20)21)12-14-8-5-4-6-9-14;1-18(2,3)23-17(22)19-15(16(20)21)11-12-8-9-13-6-4-5-7-14(13)10-12;1-2-17-14(18)15(9-6-10-16-12-15)11-13-7-4-3-5-8-13;1-11(2,3)17-9(14)5-6-12(4,7-8-13)10(15)16;;;;;;/h7,9-10,12-13,16-19,21-22,30,38H,6,8,11,14-15,20,23-29,31-33H2,1-5H3,(H,47,55)(H,48,56)(H,49,54);4,6-7,9-10,13-16,18-19,27,35H,3,5,8,11-12,17,20-26,28-30,42H2,1-2H3,(H,43,50)(H,44,49);7-11,13-18,25,33H,6,12,19-24,26-28H2,1-5H3,(H,41,47)(H,42,46);4-8,10-15,22,30,36H,3,9,16-21,23-25H2,1-2H3,(H,37,42)(H,38,41);6-10,12-17,20,28H,5,11,18-19,21-23H2,1-4H3,(H,34,38)(H,35,39);3-7,9-14,17,25H,2,8,15-16,18-20,29H2,1H3,(H,30,33);6-8,10-11H,5,9,12-15H2,1-4H3,(H,21,23);4-6,8-9H,7,10-13H2,1-3H3,(H,20,21);4-10,15H,11H2,1-3H3,(H,19,22)(H,20,21);3-5,7-8,16H,2,6,9-12H2,1H3,(H,17,18);5-8,13H2,1-4H3,(H,15,16);6*1H4/t38?,46-;35?,41-;33?,40-;30?,35-;28?,33-;25?,28-;20-;18-;;15-;;;;;;;/m00000000.0......./s1
InChIKeyZQBRJJFWMVZFLR-WHRCWZGJSA-N
XLogP47.84
TPSA955.61 Ų
H-Bond Donors23
H-Bond Acceptors42
Rotatable Bonds83
Heavy Atoms383
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005258.07
LogP ≤ 547.84
H-Bond Donors ≤ 523
H-Bond Acceptors ≤ 1042

Analyze 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid with MolForge

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Related Compounds

(3S)-3-benzyl-1-[(2S)-2-[[1-(3,3-dimethylbutanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-N-ethylpiperidine-3-carboxamide
CID 70971922
4-[6-[(2-acetamido-3-sulfanylpropanoyl)amino]hexanoyl]-N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]piperazine-1-carboxamide;4-[6-[(2-acetamido-3-tritylsulfanylpropanoyl)amino]hexanoyl]-N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]piperazine-1-carboxamide;(3S)-1-[2-amino-3-(3,4-dichlorophenyl)propanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]piperazine-1-carboxamide;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]carbamoyl]piperazine-1-carboxylate;tert-butyl piperazine-1-carboxylate;(2,5-dioxocyclopentyl) N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]carbamate;methane
CID 159619929
tert-butyl N-[6-[(3R)-3-[[(2S)-1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]carbamoylamino]piperidin-1-yl]-6-oxohexyl]carbamate
CID 58107755
(3S)-1-[(2R)-2-[6-[(2-acetamido-3-sulfanylpropanoyl)amino]hexanoylamino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide
CID 58107787
S-[2-[[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoylamino]butylamino]-6-oxohexyl]amino]-2-oxoethyl] ethanethioate
CID 89150623
(3S)-1-[(2R)-2-[[3-(6-aminohexanoylamino)-1-methylsulfanylcyclopentanecarbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide
CID 58107759
N-[(2R)-1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]piperazin-4-ium-1-carboxamide
CID 58107731
tert-butyl N-[1-[[(2R)-1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]carbamoyl]piperidin-4-yl]carbamate
CID 58107753
[6-[4-[[(2R)-1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-(3,4-dichlorophenyl)-1-oxopropan-2-yl]carbamoyl]piperazin-1-yl]-6-oxohexyl]azanium;2,2,2-trifluoroacetate
CID 160744889
(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;(1S)-1-phenylethanamine
CID 118704803
benzyl (2R)-1-[(2S)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-(phenylmethoxycarbonylamino)pentanoyl]amino]-3-naphthalen-2-ylpropanoyl]pyrrolidine-2-carboxylate
CID 10350118
tritert-butyl 10-[6-(phenylmethoxycarbonylamino)hexanoyl]-1,4,7,10-tetrazacyclododecane-1,4,7-tricarboxylate
CID 118541021

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid?
The IUPAC name of 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid (CID 162189264) is 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid.
What is the SMILES notation for 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid?
The canonical SMILES for 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid is C.C.C.C.C.C.CC(C)(C)OC(=O)CCC(C)(CCN)C(=O)O.CC(C)(C)OC(=O)N1CCC[C@@](Cc2ccccc2)(C(=O)O)C1.CC(C)(C)OC(=O)NC(Cc1ccc2ccccc2c1)C(=O)O.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCN(C(=O)CCCCCN)CC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCN(C(=O)CCCCCNC(=O)OC(C)(C)C)CC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCN(C(=O)OC(C)(C)C)CC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)C2(C)CCNCC2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(Cc2ccc3ccccc3c2)NC(=O)OC(C)(C)C)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)C(N)Cc2ccc3ccccc3c2)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCN(C(=O)OC(C)(C)C)C1.CCNC(=O)[C@]1(Cc2ccccc2)CCCNC1.
What is the InChIKey of 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid?
The InChIKey is ZQBRJJFWMVZFLR-WHRCWZGJSA-N. The full InChI is InChI=1S/C46H63N5O6.C41H55N5O4.C40H52N4O5.C35H44N4O3.C33H41N3O4.C28H33N3O2.C20H30N2O3.C18H25NO4.C18H21NO4.C15H22N2O.C12H23NO4.6CH4/c1-6-47-42(55)46(32-34-16-9-7-10-17-34)23-15-27-51(33-46)40(53)38(31-35-21-22-36-18-12-13-19-37(36)30-35)49-41(54)45(5)24-28-50(29-25-45)39(52)20-11-8-14-26-48-43(56)57-44(2,3)4;1-3-43-39(50)41(29-31-13-6-4-7-14-31)20-12-24-46(30-41)37(48)35(28-32-18-19-33-15-9-10-16-34(33)27-32)44-38(49)40(2)21-25-45(26-22-40)36(47)17-8-5-11-23-42;1-6-41-36(47)40(27-29-13-8-7-9-14-29)19-12-22-44(28-40)34(45)33(26-30-17-18-31-15-10-11-16-32(31)25-30)42-35(46)39(5)20-23-43(24-21-39)37(48)49-38(2,3)4;1-3-37-33(42)35(24-26-10-5-4-6-11-26)16-9-21-39(25-35)31(40)30(38-32(41)34(2)17-19-36-20-18-34)23-27-14-15-28-12-7-8-13-29(28)22-27;1-5-34-30(38)33(22-24-12-7-6-8-13-24)18-11-19-36(23-33)29(37)28(35-31(39)40-32(2,3)4)21-25-16-17-26-14-9-10-15-27(26)20-25;1-2-30-27(33)28(19-21-9-4-3-5-10-21)15-8-16-31(20-28)26(32)25(29)18-22-13-14-23-11-6-7-12-24(23)17-22;1-5-21-17(23)20(14-16-10-7-6-8-11-16)12-9-13-22(15-20)18(24)25-19(2,3)4;1-17(2,3)23-16(22)19-11-7-10-18(13-19,15(20)21)12-14-8-5-4-6-9-14;1-18(2,3)23-17(22)19-15(16(20)21)11-12-8-9-13-6-4-5-7-14(13)10-12;1-2-17-14(18)15(9-6-10-16-12-15)11-13-7-4-3-5-8-13;1-11(2,3)17-9(14)5-6-12(4,7-8-13)10(15)16;;;;;;/h7,9-10,12-13,16-19,21-22,30,38H,6,8,11,14-15,20,23-29,31-33H2,1-5H3,(H,47,55)(H,48,56)(H,49,54);4,6-7,9-10,13-16,18-19,27,35H,3,5,8,11-12,17,20-26,28-30,42H2,1-2H3,(H,43,50)(H,44,49);7-11,13-18,25,33H,6,12,19-24,26-28H2,1-5H3,(H,41,47)(H,42,46);4-8,10-15,22,30,36H,3,9,16-21,23-25H2,1-2H3,(H,37,42)(H,38,41);6-10,12-17,20,28H,5,11,18-19,21-23H2,1-4H3,(H,34,38)(H,35,39);3-7,9-14,17,25H,2,8,15-16,18-20,29H2,1H3,(H,30,33);6-8,10-11H,5,9,12-15H2,1-4H3,(H,21,23);4-6,8-9H,7,10-13H2,1-3H3,(H,20,21);4-10,15H,11H2,1-3H3,(H,19,22)(H,20,21);3-5,7-8,16H,2,6,9-12H2,1H3,(H,17,18);5-8,13H2,1-4H3,(H,15,16);6*1H4/t38?,46-;35?,41-;33?,40-;30?,35-;28?,33-;25?,28-;20-;18-;;15-;;;;;;;/m00000000.0......./s1.
What are the key properties of 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid?
2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid has a molecular weight of 5258.07 g/mol, XLogP of 47.84, 83 rotatable bonds, 23 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-2-methyl-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid;(3S)-1-[2-[[1-(6-aminohexanoyl)-4-methylpiperidine-4-carbonyl]amino]-3-naphthalen-2-ylpropanoyl]-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-1-(2-amino-3-naphthalen-2-ylpropanoyl)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-N-ethyl-1-[2-[(4-methylpiperidine-4-carbonyl)amino]-3-naphthalen-2-ylpropanoyl]piperidine-3-carboxamide;(3S)-3-benzyl-N-ethylpiperidine-3-carboxamide;(3S)-3-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid;tert-butyl (3S)-3-benzyl-3-(ethylcarbamoyl)piperidine-1-carboxylate;tert-butyl N-[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamate;tert-butyl 4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidine-1-carboxylate;tert-butyl N-[6-[4-[[1-[(3S)-3-benzyl-3-(ethylcarbamoyl)piperidin-1-yl]-3-naphthalen-2-yl-1-oxopropan-2-yl]carbamoyl]-4-methylpiperidin-1-yl]-6-oxohexyl]carbamate;methane;2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-naphthalen-2-ylpropanoic acid is sourced from PubChem (CID 162189264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).