tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide

C212H290B2F9N15O46S3Si3 — CID 160646023

IUPACtert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide
SMILESC1CCNC1.CC(=O)c1cc(O)ccc1O.CC(C)(C)OC(=O)N1CCC(=O)CC1.CC(C)(C)OC(=O)N1CCC2(C=C(OS(=O)(=O)C(F)(F)F)c3cc(O[Si](C)(C)C(C)(C)C)ccc3O2)CC1.CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)c1cc(O)ccc1O2.CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)c1cc(O[Si](C)(C)C(C)(C)C)ccc1O2.CCN(CC)C(=O)c1ccc(B(O)O)cc1.CCN(CC)C(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)cn1.CCN(CC)C(=O)c1ccc(C2=CC3(CCN(C(=O)OC(C)(C)C)CC3)Oc3ccc(O)cc32)cc1.CCN(CC)C(=O)c1ccc(C2=CC3(CCN(C(=O)OC(C)(C)C)CC3)Oc3ccc(O[Si](C)(C)C(C)(C)C)cc32)cc1.CCN(CC)C(=O)c1ccc(C2=CC3(CCNCC3)Oc3ccc(O)cc32)cc1.O=S(=O)(N(SOOC(F)(F)F)c1ccccc1)C(F)(F)F
InChIInChI=1S/C35H50N2O5Si.C29H36N2O5.C25H36F3NO7SSi.C24H28N2O3.C24H37NO5Si.C18H23NO5.C16H25BN2O3.C11H16BNO3.C10H17NO3.C8H5F6NO4S2.C8H8O3.C4H9N/c1-11-36(12-2)31(38)26-15-13-25(14-16-26)29-24-35(19-21-37(22-20-35)32(39)41-33(3,4)5)40-30-18-17-27(23-28(29)30)42-43(9,10)34(6,7)8;1-6-30(7-2)26(33)21-10-8-20(9-11-21)24-19-29(35-25-13-12-22(32)18-23(24)25)14-16-31(17-15-29)27(34)36-28(3,4)5;1-22(2,3)34-21(30)29-13-11-24(12-14-29)16-20(35-37(31,32)25(26,27)28)18-15-17(9-10-19(18)33-24)36-38(7,8)23(4,5)6;1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-10-9-19(27)15-20(21)22;1-22(2,3)29-21(27)25-13-11-24(12-14-25)16-19(26)18-15-17(9-10-20(18)28-24)30-31(7,8)23(4,5)6;1-17(2,3)24-16(22)19-8-6-18(7-9-19)11-14(21)13-10-12(20)4-5-15(13)23-18;1-7-19(8-2)14(20)13-10-9-12(11-18-13)17-21-15(3,4)16(5,6)22-17;1-3-13(4-2)11(14)9-5-7-10(8-6-9)12(15)16;1-10(2,3)14-9(13)11-6-4-8(12)5-7-11;9-7(10,11)18-19-20-15(6-4-2-1-3-5-6)21(16,17)8(12,13)14;1-5(9)7-4-6(10)2-3-8(7)11;1-2-4-5-3-1/h13-18,23-24H,11-12,19-22H2,1-10H3;8-13,18-19,32H,6-7,14-17H2,1-5H3;9-10,15-16H,11-14H2,1-8H3;5-10,15-16,25,27H,3-4,11-14H2,1-2H3;9-10,15H,11-14,16H2,1-8H3;4-5,10,20H,6-9,11H2,1-3H3;9-11H,7-8H2,1-6H3;5-8,15-16H,3-4H2,1-2H3;4-7H2,1-3H3;1-5H;2-4,10-11H,1H3;5H,1-4H2
InChIKeyRJUIIGSMAMIYGR-UHFFFAOYSA-N
MW4157.78 g/mol
LogP41.15
Rot. Bonds34

About tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide

tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide (PubChem CID 160646023) has the molecular formula C212H290B2F9N15O46S3Si3 and a molecular weight of 4157.78 g/mol. Its IUPAC name is tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide.

Molecular Properties

Compound Nametert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide
PubChem CID160646023
Molecular FormulaC212H290B2F9N15O46S3Si3
Molecular Weight4157.78 g/mol
Exact Mass4154.93
IUPAC Nametert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide
SMILESC1CCNC1.CC(=O)c1cc(O)ccc1O.CC(C)(C)OC(=O)N1CCC(=O)CC1.CC(C)(C)OC(=O)N1CCC2(C=C(OS(=O)(=O)C(F)(F)F)c3cc(O[Si](C)(C)C(C)(C)C)ccc3O2)CC1.CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)c1cc(O)ccc1O2.CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)c1cc(O[Si](C)(C)C(C)(C)C)ccc1O2.CCN(CC)C(=O)c1ccc(B(O)O)cc1.CCN(CC)C(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)cn1.CCN(CC)C(=O)c1ccc(C2=CC3(CCN(C(=O)OC(C)(C)C)CC3)Oc3ccc(O)cc32)cc1.CCN(CC)C(=O)c1ccc(C2=CC3(CCN(C(=O)OC(C)(C)C)CC3)Oc3ccc(O[Si](C)(C)C(C)(C)C)cc32)cc1.CCN(CC)C(=O)c1ccc(C2=CC3(CCNCC3)Oc3ccc(O)cc32)cc1.O=S(=O)(N(SOOC(F)(F)F)c1ccccc1)C(F)(F)F
InChIInChI=1S/C35H50N2O5Si.C29H36N2O5.C25H36F3NO7SSi.C24H28N2O3.C24H37NO5Si.C18H23NO5.C16H25BN2O3.C11H16BNO3.C10H17NO3.C8H5F6NO4S2.C8H8O3.C4H9N/c1-11-36(12-2)31(38)26-15-13-25(14-16-26)29-24-35(19-21-37(22-20-35)32(39)41-33(3,4)5)40-30-18-17-27(23-28(29)30)42-43(9,10)34(6,7)8;1-6-30(7-2)26(33)21-10-8-20(9-11-21)24-19-29(35-25-13-12-22(32)18-23(24)25)14-16-31(17-15-29)27(34)36-28(3,4)5;1-22(2,3)34-21(30)29-13-11-24(12-14-29)16-20(35-37(31,32)25(26,27)28)18-15-17(9-10-19(18)33-24)36-38(7,8)23(4,5)6;1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-10-9-19(27)15-20(21)22;1-22(2,3)29-21(27)25-13-11-24(12-14-25)16-19(26)18-15-17(9-10-20(18)28-24)30-31(7,8)23(4,5)6;1-17(2,3)24-16(22)19-8-6-18(7-9-19)11-14(21)13-10-12(20)4-5-15(13)23-18;1-7-19(8-2)14(20)13-10-9-12(11-18-13)17-21-15(3,4)16(5,6)22-17;1-3-13(4-2)11(14)9-5-7-10(8-6-9)12(15)16;1-10(2,3)14-9(13)11-6-4-8(12)5-7-11;9-7(10,11)18-19-20-15(6-4-2-1-3-5-6)21(16,17)8(12,13)14;1-5(9)7-4-6(10)2-3-8(7)11;1-2-4-5-3-1/h13-18,23-24H,11-12,19-22H2,1-10H3;8-13,18-19,32H,6-7,14-17H2,1-5H3;9-10,15-16H,11-14H2,1-8H3;5-10,15-16,25,27H,3-4,11-14H2,1-2H3;9-10,15H,11-14,16H2,1-8H3;4-5,10,20H,6-9,11H2,1-3H3;9-11H,7-8H2,1-6H3;5-8,15-16H,3-4H2,1-2H3;4-7H2,1-3H3;1-5H;2-4,10-11H,1H3;5H,1-4H2
InChIKeyRJUIIGSMAMIYGR-UHFFFAOYSA-N
XLogP41.15
TPSA726.37 Ų
H-Bond Donors9
H-Bond Acceptors50
Rotatable Bonds34
Heavy Atoms290
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004157.78
LogP ≤ 541.15
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1050

Analyze tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl 5-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 5-(methoxymethoxy)-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 5-(methoxymethoxy)-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide;1-(2,6-dihydroxyphenyl)ethanone;methane;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide
CID 162179828
tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-5-(methoxymethoxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 5-(methoxymethoxy)-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(5-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide
CID 158326917
tert-butyl 7-acetyl-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-7-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-7-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;1-O'-tert-butyl 7-O-methyl 4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1',7-dicarboxylate;4-[4-(diethylcarbamoyl)phenyl]-1'-[(2-methylpropan-2-yl)oxycarbonyl]spiro[chromene-2,4'-piperidine]-7-carboxylic acid;methyl 4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-7-carboxylate;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide
CID 160954877
CID 159919094
CID 159919094
tert-butyl 4'-[4-(diethylcarbamoyl)phenyl]spiro[8-azabicyclo[3.2.1]octane-3,2'-chromene]-8-carboxylate;tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 4-oxospiro[3H-chromene-2,3'-8-azabicyclo[3.2.1]octane]-8'-carboxylate;tert-butyl 4'-(trifluoromethylsulfonyloxy)spiro[8-azabicyclo[3.2.1]octane-3,2'-chromene]-8-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-spiro[8-azabicyclo[3.2.1]octane-3,2'-chromene]-4'-ylbenzamide;methanol;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide
CID 158648837
tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-3,6,7,8-tetramethylspiro[5H-chromen-5-ide-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;tert-butyl 3,6,7,8-tetramethyl-4-oxospiro[3,5-dihydrochromen-5-ide-2,4'-piperidine]-1'-carboxylate;tert-butyl 3,6,7,8-tetramethyl-4-(trifluoromethylsulfonyloxy)spiro[5H-chromen-5-ide-2,4'-piperidine]-1'-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;N,N-diethyl-4-(3,6,7,8-tetramethylspiro[5H-chromen-5-ide-2,4'-piperidine]-4-yl)benzamide;1-(2-hydroxy-3,4,5-trimethylbenzene-6-id-1-yl)propan-1-one;pentakis(ruthenium(1+));1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide
CID 158585491
benzyl 5-oxooxazinane-2-carboxylate;benzyl 4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;benzyl 4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;1-(2-hydroxyphenyl)ethanone;methane;methanol;pyrrolidine;4,4,5,5-tetramethyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3,2-dioxaborolane;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide
CID 159735230
CID 159482624
CID 159482624
tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate
CID 59674616
tert-butyl 4'-methylsulfonyloxyspiro[8-azabicyclo[3.2.1]octane-3,2'-chromene]-8-carboxylate;tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate;tert-butyl 4-oxospiro[3H-chromene-2,3'-8-azabicyclo[3.2.1]octane]-8'-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-spiro[chromene-2,3'-piperidine]-4-ylbenzamide;1-(2-hydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-methyl-N-phenylmethanesulfonamide
CID 161400443
CID 158270527
CID 158270527
bis(tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-3'-methylspiro[chromene-2,4'-piperidine]-1'-carboxylate);bis(tert-butyl 3'-methyl-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate);bis([4-(diethylcarbamoyl)phenyl]boronic acid);bis(N,N-diethyl-4-(3'-methylspiro[chromene-2,4'-piperidine]-4-yl)benzamide)
CID 157475269

Frequently Asked Questions

What is the IUPAC name of tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide?
The IUPAC name of tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide (CID 160646023) is tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide.
What is the SMILES notation for tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide?
The canonical SMILES for tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide is C1CCNC1.CC(=O)c1cc(O)ccc1O.CC(C)(C)OC(=O)N1CCC(=O)CC1.CC(C)(C)OC(=O)N1CCC2(C=C(OS(=O)(=O)C(F)(F)F)c3cc(O[Si](C)(C)C(C)(C)C)ccc3O2)CC1.CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)c1cc(O)ccc1O2.CC(C)(C)OC(=O)N1CCC2(CC1)CC(=O)c1cc(O[Si](C)(C)C(C)(C)C)ccc1O2.CCN(CC)C(=O)c1ccc(B(O)O)cc1.CCN(CC)C(=O)c1ccc(B2OC(C)(C)C(C)(C)O2)cn1.CCN(CC)C(=O)c1ccc(C2=CC3(CCN(C(=O)OC(C)(C)C)CC3)Oc3ccc(O)cc32)cc1.CCN(CC)C(=O)c1ccc(C2=CC3(CCN(C(=O)OC(C)(C)C)CC3)Oc3ccc(O[Si](C)(C)C(C)(C)C)cc32)cc1.CCN(CC)C(=O)c1ccc(C2=CC3(CCNCC3)Oc3ccc(O)cc32)cc1.O=S(=O)(N(SOOC(F)(F)F)c1ccccc1)C(F)(F)F.
What is the InChIKey of tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide?
The InChIKey is RJUIIGSMAMIYGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H50N2O5Si.C29H36N2O5.C25H36F3NO7SSi.C24H28N2O3.C24H37NO5Si.C18H23NO5.C16H25BN2O3.C11H16BNO3.C10H17NO3.C8H5F6NO4S2.C8H8O3.C4H9N/c1-11-36(12-2)31(38)26-15-13-25(14-16-26)29-24-35(19-21-37(22-20-35)32(39)41-33(3,4)5)40-30-18-17-27(23-28(29)30)42-43(9,10)34(6,7)8;1-6-30(7-2)26(33)21-10-8-20(9-11-21)24-19-29(35-25-13-12-22(32)18-23(24)25)14-16-31(17-15-29)27(34)36-28(3,4)5;1-22(2,3)34-21(30)29-13-11-24(12-14-29)16-20(35-37(31,32)25(26,27)28)18-15-17(9-10-19(18)33-24)36-38(7,8)23(4,5)6;1-3-26(4-2)23(28)18-7-5-17(6-8-18)21-16-24(11-13-25-14-12-24)29-22-10-9-19(27)15-20(21)22;1-22(2,3)29-21(27)25-13-11-24(12-14-25)16-19(26)18-15-17(9-10-20(18)28-24)30-31(7,8)23(4,5)6;1-17(2,3)24-16(22)19-8-6-18(7-9-19)11-14(21)13-10-12(20)4-5-15(13)23-18;1-7-19(8-2)14(20)13-10-9-12(11-18-13)17-21-15(3,4)16(5,6)22-17;1-3-13(4-2)11(14)9-5-7-10(8-6-9)12(15)16;1-10(2,3)14-9(13)11-6-4-8(12)5-7-11;9-7(10,11)18-19-20-15(6-4-2-1-3-5-6)21(16,17)8(12,13)14;1-5(9)7-4-6(10)2-3-8(7)11;1-2-4-5-3-1/h13-18,23-24H,11-12,19-22H2,1-10H3;8-13,18-19,32H,6-7,14-17H2,1-5H3;9-10,15-16H,11-14H2,1-8H3;5-10,15-16,25,27H,3-4,11-14H2,1-2H3;9-10,15H,11-14,16H2,1-8H3;4-5,10,20H,6-9,11H2,1-3H3;9-11H,7-8H2,1-6H3;5-8,15-16H,3-4H2,1-2H3;4-7H2,1-3H3;1-5H;2-4,10-11H,1H3;5H,1-4H2.
What are the key properties of tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide?
tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide has a molecular weight of 4157.78 g/mol, XLogP of 41.15, 34 rotatable bonds, 9 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-[4-(diethylcarbamoyl)phenyl]spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-[tert-butyl(dimethyl)silyl]oxy-4-(trifluoromethylsulfonyloxy)spiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-[4-(diethylcarbamoyl)phenyl]-6-hydroxyspiro[chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 6-hydroxy-4-oxospiro[3H-chromene-2,4'-piperidine]-1'-carboxylate;tert-butyl 4-oxopiperidine-1-carboxylate;[4-(diethylcarbamoyl)phenyl]boronic acid;N,N-diethyl-4-(6-hydroxyspiro[chromene-2,4'-piperidine]-4-yl)benzamide;N,N-diethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine-2-carboxamide;1-(2,5-dihydroxyphenyl)ethanone;pyrrolidine;1,1,1-trifluoro-N-phenyl-N-(trifluoromethylperoxysulfanyl)methanesulfonamide is sourced from PubChem (CID 160646023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).