tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid

C178H265ClN14O53Pd — CID 160529068

IUPACtert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid
SMILESCC(C)(C)OC(=O)N1CCCC1(CO)C(=O)O.CC(C)(C)OC(=O)N1CCCC1(COCc1ccccc1)C(=O)O.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.COC(=O)C1(COCc2ccccc2)CCCN1C(=O)OC(C)(C)C.COC(=O)[C@@H]1CCCN1.COC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C.C[C@@H](O)[C@@H](C(=O)O)N1CC2(CCCN2C(=O)OC(C)(C)C)C1=O.C[C@@H](O)[C@@H](C(N)=O)N1CC2(CCCN2C(=O)OC(C)(C)C)C1=O.C[C@@H](OCc1ccccc1)[C@@H](C(=O)OCc1ccccc1)N1CC2(CCCN2C(=O)OC(C)(C)C)C1=O.C[C@@H](OCc1ccccc1)[C@H](CC(=O)C1(CO)CCCN1C(=O)OC(C)(C)C)C(=O)OCc1ccccc1.ClCOCc1ccccc1.O=C(O)[C@@H]1CCCN1.[CH3-].[H+].[Pd]
InChIInChI=1S/C30H39NO7.C29H36N2O6.C19H27NO5.C18H25NO5.C15H25N3O5.C15H24N2O6.C11H19NO5.C11H19NO4.C10H18O5.C8H9ClO.C6H11NO2.C5H9NO2.CH3.Pd/c1-22(36-19-23-12-7-5-8-13-23)25(27(34)37-20-24-14-9-6-10-15-24)18-26(33)30(21-32)16-11-17-31(30)28(35)38-29(2,3)4;1-21(35-18-22-12-7-5-8-13-22)24(25(32)36-19-23-14-9-6-10-15-23)30-20-29(26(30)33)16-11-17-31(29)27(34)37-28(2,3)4;1-18(2,3)25-17(22)20-12-8-11-19(20,16(21)23-4)14-24-13-15-9-6-5-7-10-15;1-17(2,3)24-16(22)19-11-7-10-18(19,15(20)21)13-23-12-14-8-5-4-6-9-14;1-9(19)10(11(16)20)17-8-15(12(17)21)6-5-7-18(15)13(22)23-14(2,3)4;1-9(18)10(11(19)20)16-8-15(12(16)21)6-5-7-17(15)13(22)23-14(2,3)4;1-10(2,3)17-9(16)12-6-4-5-11(12,7-13)8(14)15;1-11(2,3)16-10(14)12-7-5-6-8(12)9(13)15-4;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;9-7-10-6-8-4-2-1-3-5-8;1-9-6(8)5-3-2-4-7-5;7-5(8)4-2-1-3-6-4;;/h5-10,12-15,22,25,32H,11,16-21H2,1-4H3;5-10,12-15,21,24H,11,16-20H2,1-4H3;5-7,9-10H,8,11-14H2,1-4H3;4-6,8-9H,7,10-13H2,1-3H3,(H,20,21);9-10,19H,5-8H2,1-4H3,(H2,16,20);9-10,18H,5-8H2,1-4H3,(H,19,20);13H,4-7H2,1-3H3,(H,14,15);8H,5-7H2,1-4H3;1-6H3;1-5H,6-7H2;5,7H,2-4H2,1H3;4,6H,1-3H2,(H,7,8);1H3;/q;;;;;;;;;;;;-1;/p+1/t22-,25+,30?;21-,24+,29?;;;2*9-,10+,15?;;8-;;;5-;4-;;/m11..11.0..00../s1
InChIKeyILCUIJSSHYWFCV-KWCFTDFZSA-O
MW3591.00 g/mol
LogP23.42
Rot. Bonds43

About tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid

tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid (PubChem CID 160529068) has the molecular formula C178H265ClN14O53Pd and a molecular weight of 3591.00 g/mol. Its IUPAC name is tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Nametert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid
PubChem CID160529068
Molecular FormulaC178H265ClN14O53Pd
Molecular Weight3591.00 g/mol
Exact Mass3587.72
IUPAC Nametert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid
SMILESCC(C)(C)OC(=O)N1CCCC1(CO)C(=O)O.CC(C)(C)OC(=O)N1CCCC1(COCc1ccccc1)C(=O)O.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.COC(=O)C1(COCc2ccccc2)CCCN1C(=O)OC(C)(C)C.COC(=O)[C@@H]1CCCN1.COC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C.C[C@@H](O)[C@@H](C(=O)O)N1CC2(CCCN2C(=O)OC(C)(C)C)C1=O.C[C@@H](O)[C@@H](C(N)=O)N1CC2(CCCN2C(=O)OC(C)(C)C)C1=O.C[C@@H](OCc1ccccc1)[C@@H](C(=O)OCc1ccccc1)N1CC2(CCCN2C(=O)OC(C)(C)C)C1=O.C[C@@H](OCc1ccccc1)[C@H](CC(=O)C1(CO)CCCN1C(=O)OC(C)(C)C)C(=O)OCc1ccccc1.ClCOCc1ccccc1.O=C(O)[C@@H]1CCCN1.[CH3-].[H+].[Pd]
InChIInChI=1S/C30H39NO7.C29H36N2O6.C19H27NO5.C18H25NO5.C15H25N3O5.C15H24N2O6.C11H19NO5.C11H19NO4.C10H18O5.C8H9ClO.C6H11NO2.C5H9NO2.CH3.Pd/c1-22(36-19-23-12-7-5-8-13-23)25(27(34)37-20-24-14-9-6-10-15-24)18-26(33)30(21-32)16-11-17-31(30)28(35)38-29(2,3)4;1-21(35-18-22-12-7-5-8-13-22)24(25(32)36-19-23-14-9-6-10-15-23)30-20-29(26(30)33)16-11-17-31(29)27(34)37-28(2,3)4;1-18(2,3)25-17(22)20-12-8-11-19(20,16(21)23-4)14-24-13-15-9-6-5-7-10-15;1-17(2,3)24-16(22)19-11-7-10-18(19,15(20)21)13-23-12-14-8-5-4-6-9-14;1-9(19)10(11(16)20)17-8-15(12(17)21)6-5-7-18(15)13(22)23-14(2,3)4;1-9(18)10(11(19)20)16-8-15(12(16)21)6-5-7-17(15)13(22)23-14(2,3)4;1-10(2,3)17-9(16)12-6-4-5-11(12,7-13)8(14)15;1-11(2,3)16-10(14)12-7-5-6-8(12)9(13)15-4;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;9-7-10-6-8-4-2-1-3-5-8;1-9-6(8)5-3-2-4-7-5;7-5(8)4-2-1-3-6-4;;/h5-10,12-15,22,25,32H,11,16-21H2,1-4H3;5-10,12-15,21,24H,11,16-20H2,1-4H3;5-7,9-10H,8,11-14H2,1-4H3;4-6,8-9H,7,10-13H2,1-3H3,(H,20,21);9-10,19H,5-8H2,1-4H3,(H2,16,20);9-10,18H,5-8H2,1-4H3,(H,19,20);13H,4-7H2,1-3H3,(H,14,15);8H,5-7H2,1-4H3;1-6H3;1-5H,6-7H2;5,7H,2-4H2,1H3;4,6H,1-3H2,(H,7,8);1H3;/q;;;;;;;;;;;;-1;/p+1/t22-,25+,30?;21-,24+,29?;;;2*9-,10+,15?;;8-;;;5-;4-;;/m11..11.0..00../s1
InChIKeyILCUIJSSHYWFCV-KWCFTDFZSA-O
XLogP23.42
TPSA851.07 Ų
H-Bond Donors11
H-Bond Acceptors51
Rotatable Bonds43
Heavy Atoms247
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003591.00
LogP ≤ 523.42
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1051

Analyze tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid with MolForge

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Related Compounds

tert-butyl 2-[[(2S,3R)-3-acetyloxy-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]carbamoyl]-2-(hydroxymethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[[(2S,3R)-3-acetyloxy-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]carbamoyl]-2-(phenylmethoxymethyl)pyrrolidine-1-carboxylate;tert-butyl 2-[(2S,3R)-3-acetyloxy-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-[(3R)-3-hydroxy-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;2-[(3R)-3-hydroxy-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]-2,5-diazaspiro[3.4]octan-3-one;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;[(2R)-4-oxo-3-(3-oxo-2,5-diazaspiro[3.4]octan-2-yl)-4-pyrrolidin-1-ylbutan-2-yl] acetate;palladium
CID 159212907
azetidine-2-carboxylic acid;1-O-tert-butyl 2-O-methyl azetidine-1,2-dicarboxylate;1-O-tert-butyl 2-O-methyl 2-benzylazetidine-1,2-dicarboxylate;methyl azetidine-2-carboxylate;hydrochloride
CID 158010630
lithium;benzyl (2S,3R)-2-(3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)-3-phenylmethoxybutanoate;benzyl (2S)-4-[4-(hydroxymethyl)-2-oxopiperidin-4-yl]-4-oxo-2-[(1R)-1-phenylmethoxyethyl]butanoate;(2S,3R)-2-(3,6-dioxo-2,7-diazaspiro[3.5]nonan-2-yl)-3-hydroxybutanoic acid;4-ethyl-2-oxopiperidine-4-carboxylic acid;4-(hydroxymethyl)-2-oxopiperidine-4-carboxylic acid;methane;methyl 4-ethyl-2-oxopiperidine-4-carboxylate;methyl 2-oxopiperidine-4-carboxylate;2-oxopiperidine-4-carboxylic acid;2-oxo-1H-pyridine-4-carboxylic acid;palladium;hydroxide;dihydrate
CID 158517428
3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid
CID 135315576
tert-butyl 2-[(3-hydroxy-1-methoxy-1-oxobutan-2-yl)carbamoyl]-2-(phenylmethoxymethyl)pyrrolidine-1-carboxylate
CID 123620552
tert-butyl 2-(methylcarbamoyl)-2-(phenylmethoxymethyl)pyrrolidine-1-carboxylate
CID 123270754
benzyl 1-[(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylate
CID 67890856
2-O-benzyl 1-O-tert-butyl (2R)-piperidine-1,2-dicarboxylate
CID 58030139
1-O-tert-butyl 2-O-methyl (4R)-4-hydroxy-2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate
CID 156704536
tert-butyl (2S)-2-[[(2R)-4-oxo-4-phenylmethoxybutan-2-yl]carbamoyl]pyrrolidine-1-carboxylate
CID 59924108
3-bromopropanenitrile;1-O-tert-butyl 2-O-methyl 2-(3-aminopropyl)pyrrolidine-1,2-dicarboxylate;1-O-tert-butyl 2-O-methyl 2-(2-cyanoethyl)pyrrolidine-1,2-dicarboxylate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 10-oxo-1,9-diazaspiro[4.5]decane-1-carboxylate;1,9-diazaspiro[4.5]decan-10-one
CID 160730860
1-O,4-O-ditert-butyl 2-O-methyl 2-(phenylmethoxymethyl)piperazine-1,2,4-tricarboxylate
CID 118358792

Frequently Asked Questions

What is the IUPAC name of tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid?
The IUPAC name of tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid (CID 160529068) is tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid.
What is the SMILES notation for tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid?
The canonical SMILES for tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid is CC(C)(C)OC(=O)N1CCCC1(CO)C(=O)O.CC(C)(C)OC(=O)N1CCCC1(COCc1ccccc1)C(=O)O.CC(C)(C)OC(=O)OC(=O)OC(C)(C)C.COC(=O)C1(COCc2ccccc2)CCCN1C(=O)OC(C)(C)C.COC(=O)[C@@H]1CCCN1.COC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C.C[C@@H](O)[C@@H](C(=O)O)N1CC2(CCCN2C(=O)OC(C)(C)C)C1=O.C[C@@H](O)[C@@H](C(N)=O)N1CC2(CCCN2C(=O)OC(C)(C)C)C1=O.C[C@@H](OCc1ccccc1)[C@@H](C(=O)OCc1ccccc1)N1CC2(CCCN2C(=O)OC(C)(C)C)C1=O.C[C@@H](OCc1ccccc1)[C@H](CC(=O)C1(CO)CCCN1C(=O)OC(C)(C)C)C(=O)OCc1ccccc1.ClCOCc1ccccc1.O=C(O)[C@@H]1CCCN1.[CH3-].[H+].[Pd].
What is the InChIKey of tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid?
The InChIKey is ILCUIJSSHYWFCV-KWCFTDFZSA-O. The full InChI is InChI=1S/C30H39NO7.C29H36N2O6.C19H27NO5.C18H25NO5.C15H25N3O5.C15H24N2O6.C11H19NO5.C11H19NO4.C10H18O5.C8H9ClO.C6H11NO2.C5H9NO2.CH3.Pd/c1-22(36-19-23-12-7-5-8-13-23)25(27(34)37-20-24-14-9-6-10-15-24)18-26(33)30(21-32)16-11-17-31(30)28(35)38-29(2,3)4;1-21(35-18-22-12-7-5-8-13-22)24(25(32)36-19-23-14-9-6-10-15-23)30-20-29(26(30)33)16-11-17-31(29)27(34)37-28(2,3)4;1-18(2,3)25-17(22)20-12-8-11-19(20,16(21)23-4)14-24-13-15-9-6-5-7-10-15;1-17(2,3)24-16(22)19-11-7-10-18(19,15(20)21)13-23-12-14-8-5-4-6-9-14;1-9(19)10(11(16)20)17-8-15(12(17)21)6-5-7-18(15)13(22)23-14(2,3)4;1-9(18)10(11(19)20)16-8-15(12(16)21)6-5-7-17(15)13(22)23-14(2,3)4;1-10(2,3)17-9(16)12-6-4-5-11(12,7-13)8(14)15;1-11(2,3)16-10(14)12-7-5-6-8(12)9(13)15-4;1-9(2,3)14-7(11)13-8(12)15-10(4,5)6;9-7-10-6-8-4-2-1-3-5-8;1-9-6(8)5-3-2-4-7-5;7-5(8)4-2-1-3-6-4;;/h5-10,12-15,22,25,32H,11,16-21H2,1-4H3;5-10,12-15,21,24H,11,16-20H2,1-4H3;5-7,9-10H,8,11-14H2,1-4H3;4-6,8-9H,7,10-13H2,1-3H3,(H,20,21);9-10,19H,5-8H2,1-4H3,(H2,16,20);9-10,18H,5-8H2,1-4H3,(H,19,20);13H,4-7H2,1-3H3,(H,14,15);8H,5-7H2,1-4H3;1-6H3;1-5H,6-7H2;5,7H,2-4H2,1H3;4,6H,1-3H2,(H,7,8);1H3;/q;;;;;;;;;;;;-1;/p+1/t22-,25+,30?;21-,24+,29?;;;2*9-,10+,15?;;8-;;;5-;4-;;/m11..11.0..00../s1.
What are the key properties of tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid?
tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid has a molecular weight of 3591.00 g/mol, XLogP of 23.42, 43 rotatable bonds, 11 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 2-[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]-3-oxo-2,5-diazaspiro[3.4]octane-5-carboxylate;tert-butyl 2-(hydroxymethyl)-2-[(3S,4R)-4-phenylmethoxy-3-phenylmethoxycarbonylpentanoyl]pyrrolidine-1-carboxylate;1-O-tert-butyl 2-O-methyl 2-(phenylmethoxymethyl)pyrrolidine-1,2-dicarboxylate;tert-butyl (2-methylpropan-2-yl)oxycarbonyl carbonate;1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate;tert-butyl 3-oxo-2-[(2S,3R)-1-oxo-1,3-bis(phenylmethoxy)butan-2-yl]-2,5-diazaspiro[3.4]octane-5-carboxylate;carbanide;chloromethoxymethylbenzene;hydron;2-(hydroxymethyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid;(2S,3R)-3-hydroxy-2-[5-[(2-methylpropan-2-yl)oxycarbonyl]-3-oxo-2,5-diazaspiro[3.4]octan-2-yl]butanoic acid;1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(phenylmethoxymethyl)pyrrolidine-2-carboxylic acid;methyl (2S)-pyrrolidine-2-carboxylate;palladium;(2S)-pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 160529068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).