1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one

C219H275ClF2N20O16 — CID 159888346

IUPAC1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one
SMILESCC(C)(C)N1C(=O)CCC1c1ccc(Cl)cc1.CC(C)(C)N1C(=O)CCC1c1ccccc1.CC(C)(C)N1C(=O)CCC1c1ccccn1.CC(C)(C)N1C(=O)CCC1c1cccnc1.CC(C)(C)N1C(=O)c2ccccc2C1c1ccccc1.CN1CC(c2ccccc2)N(C(C)(C)C)C1=O.Cc1ccc(-n2c3ccccc3c(=O)n2C(C)(C)C)cc1.Cc1ccc(C2(O)c3ccccc3C(=O)N2C(C)(C)C)cc1.Cc1ccc(C2(O)c3ncccc3C(=O)N2C(C)(C)C)c(F)c1.Cc1ccc(C2CCC(=O)N2C(C)(C)C)c(F)c1.Cc1ccc(C2CCC(=O)N2C(C)(C)C)cc1.Cc1ccc(C2CCC(=O)N2C(C)(C)C)cc1.Cc1ccc(C2c3ccccc3C(=O)N2C(C)(C)C)cc1.Cc1ccc(N2CCC(=O)N2C(C)(C)C)cc1
InChIInChI=1S/C19H21NO2.C19H21NO.C18H19FN2O2.C18H20N2O.C18H19NO.C15H20FNO.2C15H21NO.C14H18ClNO.2C14H20N2O.C14H19NO.2C13H18N2O/c1-13-9-11-14(12-10-13)19(22)16-8-6-5-7-15(16)17(21)20(19)18(2,3)4;1-13-9-11-14(12-10-13)17-15-7-5-6-8-16(15)18(21)20(17)19(2,3)4;1-11-7-8-13(14(19)10-11)18(23)15-12(6-5-9-20-15)16(22)21(18)17(2,3)4;1-13-9-11-14(12-10-13)19-16-8-6-5-7-15(16)17(21)20(19)18(2,3)4;1-18(2,3)19-16(13-9-5-4-6-10-13)14-11-7-8-12-15(14)17(19)20;1-10-5-6-11(12(16)9-10)13-7-8-14(18)17(13)15(2,3)4;2*1-11-5-7-12(8-6-11)13-9-10-14(17)16(13)15(2,3)4;1-14(2,3)16-12(8-9-13(16)17)10-4-6-11(15)7-5-10;1-11-5-7-12(8-6-11)15-10-9-13(17)16(15)14(2,3)4;1-14(2,3)16-12(10-15(4)13(16)17)11-8-6-5-7-9-11;1-14(2,3)15-12(9-10-13(15)16)11-7-5-4-6-8-11;1-13(2,3)15-11(6-7-12(15)16)10-5-4-8-14-9-10;1-13(2,3)15-11(7-8-12(15)16)10-6-4-5-9-14-10/h5-12,22H,1-4H3;5-12,17H,1-4H3;5-10,23H,1-4H3;5-12H,1-4H3;4-12,16H,1-3H3;5-6,9,13H,7-8H2,1-4H3;2*5-8,13H,9-10H2,1-4H3;4-7,12H,8-9H2,1-3H3;5-8H,9-10H2,1-4H3;5-9,12H,10H2,1-4H3;4-8,12H,9-10H2,1-3H3;4-5,8-9,11H,6-7H2,1-3H3;4-6,9,11H,7-8H2,1-3H3
InChIKeyNUKQMSFMTDAOPK-UHFFFAOYSA-N
MW3517.18 g/mol
LogP46.83
Rot. Bonds14

About 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one

1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one (PubChem CID 159888346) has the molecular formula C219H275ClF2N20O16 and a molecular weight of 3517.18 g/mol. Its IUPAC name is 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one.

Molecular Properties

Compound Name1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one
PubChem CID159888346
Molecular FormulaC219H275ClF2N20O16
Molecular Weight3517.18 g/mol
Exact Mass3514.10
IUPAC Name1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one
SMILESCC(C)(C)N1C(=O)CCC1c1ccc(Cl)cc1.CC(C)(C)N1C(=O)CCC1c1ccccc1.CC(C)(C)N1C(=O)CCC1c1ccccn1.CC(C)(C)N1C(=O)CCC1c1cccnc1.CC(C)(C)N1C(=O)c2ccccc2C1c1ccccc1.CN1CC(c2ccccc2)N(C(C)(C)C)C1=O.Cc1ccc(-n2c3ccccc3c(=O)n2C(C)(C)C)cc1.Cc1ccc(C2(O)c3ccccc3C(=O)N2C(C)(C)C)cc1.Cc1ccc(C2(O)c3ncccc3C(=O)N2C(C)(C)C)c(F)c1.Cc1ccc(C2CCC(=O)N2C(C)(C)C)c(F)c1.Cc1ccc(C2CCC(=O)N2C(C)(C)C)cc1.Cc1ccc(C2CCC(=O)N2C(C)(C)C)cc1.Cc1ccc(C2c3ccccc3C(=O)N2C(C)(C)C)cc1.Cc1ccc(N2CCC(=O)N2C(C)(C)C)cc1
InChIInChI=1S/C19H21NO2.C19H21NO.C18H19FN2O2.C18H20N2O.C18H19NO.C15H20FNO.2C15H21NO.C14H18ClNO.2C14H20N2O.C14H19NO.2C13H18N2O/c1-13-9-11-14(12-10-13)19(22)16-8-6-5-7-15(16)17(21)20(19)18(2,3)4;1-13-9-11-14(12-10-13)17-15-7-5-6-8-16(15)18(21)20(17)19(2,3)4;1-11-7-8-13(14(19)10-11)18(23)15-12(6-5-9-20-15)16(22)21(18)17(2,3)4;1-13-9-11-14(12-10-13)19-16-8-6-5-7-15(16)17(21)20(19)18(2,3)4;1-18(2,3)19-16(13-9-5-4-6-10-13)14-11-7-8-12-15(14)17(19)20;1-10-5-6-11(12(16)9-10)13-7-8-14(18)17(13)15(2,3)4;2*1-11-5-7-12(8-6-11)13-9-10-14(17)16(13)15(2,3)4;1-14(2,3)16-12(8-9-13(16)17)10-4-6-11(15)7-5-10;1-11-5-7-12(8-6-11)15-10-9-13(17)16(15)14(2,3)4;1-14(2,3)16-12(10-15(4)13(16)17)11-8-6-5-7-9-11;1-14(2,3)15-12(9-10-13(15)16)11-7-5-4-6-8-11;1-13(2,3)15-11(6-7-12(15)16)10-5-4-8-14-9-10;1-13(2,3)15-11(7-8-12(15)16)10-6-4-5-9-14-10/h5-12,22H,1-4H3;5-12,17H,1-4H3;5-10,23H,1-4H3;5-12H,1-4H3;4-12,16H,1-3H3;5-6,9,13H,7-8H2,1-4H3;2*5-8,13H,9-10H2,1-4H3;4-7,12H,8-9H2,1-3H3;5-8H,9-10H2,1-4H3;5-9,12H,10H2,1-4H3;4-8,12H,9-10H2,1-3H3;4-5,8-9,11H,6-7H2,1-3H3;4-6,9,11H,7-8H2,1-3H3
InChIKeyNUKQMSFMTDAOPK-UHFFFAOYSA-N
XLogP46.83
TPSA376.57 Ų
H-Bond Donors2
H-Bond Acceptors22
Rotatable Bonds14
Heavy Atoms258
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003517.18
LogP ≤ 546.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1022

Analyze 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one with MolForge

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Launch Full Analysis

Related Compounds

3-benzyl-2-tert-butyl-3H-isoindol-1-one;2-tert-butyl-5-fluoro-1-(6-methyl-3-pyridinyl)indazol-3-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;2-tert-butyl-1-hydroxy-1-(6-methyl-3-pyridinyl)pyrrolo[3,4-c]pyridin-3-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(6-methyl-3-pyridinyl)pyrazolo[4,3-c]pyridin-3-one;2-tert-butyl-1-(6-methyl-3-pyridinyl)-1H-pyrrolo[3,4-c]pyridin-3-one;1-tert-butyl-5-phenylimidazolidin-2-one;2-tert-butyl-3-pyridin-2-yl-3H-isoindol-1-one;2-tert-butyl-3-pyridin-3-yl-3H-isoindol-1-one;2-tert-butyl-3-pyridin-4-yl-3H-isoindol-1-one
CID 157405853
6-tert-butyl-5-(4-chlorophenyl)-5-hydroxypyrrolo[3,4-b]pyridin-7-one;2-tert-butyl-1-(4-chlorophenyl)-1-hydroxypyrrolo[3,4-c]pyridin-3-one;2-tert-butyl-1-(4-fluorophenyl)pyrazolo[4,3-b]pyridin-3-one;bis(6-tert-butyl-5-hydroxy-5-(4-methylphenyl)pyrrolo[3,4-b]pyridin-7-one);bis(2-tert-butyl-1-hydroxy-1-(4-methylphenyl)pyrrolo[3,4-c]pyridin-3-one);bis(2-tert-butyl-1-(4-methylphenyl)pyrazolo[4,3-b]pyridin-3-one);bis(2-tert-butyl-1-(4-methylphenyl)-1H-pyrrolo[3,4-c]pyridin-3-one);2-methyl-1-(4-methylphenyl)-1H-pyrrolo[3,4-c]pyridin-3-one
CID 159177146
2-tert-butyl-3-(4-chlorophenyl)-3-hydroxypyrrolo[3,4-c]pyridin-1-one;2-tert-butyl-1-(4-fluorophenyl)pyrazolo[3,4-c]pyridin-3-one;bis(2-tert-butyl-3-hydroxy-3-(4-methylphenyl)pyrrolo[3,4-c]pyridin-1-one);bis(2-tert-butyl-1-(4-methylphenyl)pyrazolo[3,4-c]pyridin-3-one);tris(2-tert-butyl-1-(4-methylphenyl)pyrazolo[4,3-c]pyridin-3-one);bis(2-tert-butyl-3-(4-methylphenyl)-3H-pyrrolo[3,4-c]pyridin-1-one);3-(4-fluorophenyl)-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one
CID 159264869
6-tert-butyl-7-(4-chlorophenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;2-tert-butyl-1-(4-chlorophenyl)pyrazolo[3,4-b]pyridin-3-one;bis(6-tert-butyl-7-hydroxy-7-(4-methylphenyl)pyrrolo[3,4-b]pyridin-5-one);bis(2-tert-butyl-1-(4-methylphenyl)pyrazolo[3,4-b]pyridin-3-one);bis(6-tert-butyl-7-(4-methylphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one);6-methyl-7-(4-methylphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one
CID 160292832
6-tert-butyl-5-(4-chlorophenyl)-5-hydroxypyrrolo[3,4-b]pyridin-7-one;2-tert-butyl-5-fluoro-1-(5-methyl-2-pyridinyl)indazol-3-one;2-tert-butyl-5-fluoro-1-(6-methyl-3-pyridinyl)indazol-3-one;2-tert-butyl-6-fluoro-3-(5-methyl-2-pyridinyl)-3H-isoindol-1-one;bis(6-tert-butyl-5-hydroxy-5-(4-methylphenyl)pyrrolo[3,4-b]pyridin-7-one);2-tert-butyl-1-hydroxy-1-(6-methyl-3-pyridinyl)pyrrolo[3,4-c]pyridin-3-one;2-tert-butyl-5-methyl-1-(6-methyl-3-pyridinyl)indazol-3-one;tris(2-tert-butyl-1-(4-methylphenyl)pyrazolo[4,3-b]pyridin-3-one);tris(6-tert-butyl-5-(4-methylphenyl)-5H-pyrrolo[3,4-b]pyridin-7-one);2-tert-butyl-1-(6-methyl-3-pyridinyl)pyrazolo[4,3-c]pyridin-3-one;2-tert-butyl-3-(6-methyl-3-pyridinyl)-3H-pyrrolo[3,4-c]pyridin-1-one;6-fluoro-3-hydroxy-2-methyl-3-(5-methyl-2-pyridinyl)isoindol-1-one
CID 161454400
2-tert-butyl-5-fluoro-1-(5-methyl-2-pyridinyl)indazol-3-one;2-tert-butyl-6-fluoro-3-(5-methyl-2-pyridinyl)-3H-isoindol-1-one;2-tert-butyl-5-methyl-1-(6-methyl-3-pyridinyl)indazol-3-one;tris(6-tert-butyl-5-(4-methylphenyl)-5H-pyrrolo[3,4-b]pyridin-7-one);6-fluoro-3-hydroxy-2-methyl-3-(5-methyl-2-pyridinyl)isoindol-1-one
CID 161649005
3-benzyl-2-tert-butyl-3H-isoindol-1-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;bis(2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one);3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;bis(2-tert-butyl-1-(4-methylphenyl)indazol-3-one);bis(2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one);2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;tris(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);1-tert-butyl-5-phenylimidazolidin-2-one;2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;2-tert-butyl-3-pyridin-2-yl-3H-isoindol-1-one;2-tert-butyl-3-pyridin-3-yl-3H-isoindol-1-one;2-tert-butyl-3-pyridin-4-yl-3H-isoindol-1-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one
CID 161867727
2-tert-butyl-1-(4-chlorophenyl)-1-hydroxypyrrolo[3,4-c]pyridin-3-one;2-tert-butyl-3-(4-chlorophenyl)-3-hydroxypyrrolo[3,4-c]pyridin-1-one;bis(2-tert-butyl-1-hydroxy-1-(4-methylphenyl)pyrrolo[3,4-c]pyridin-3-one);bis(2-tert-butyl-3-hydroxy-3-(4-methylphenyl)pyrrolo[3,4-c]pyridin-1-one);tris(2-tert-butyl-1-(4-methylphenyl)pyrazolo[3,4-c]pyridin-3-one);tris(2-tert-butyl-1-(4-methylphenyl)pyrazolo[4,3-c]pyridin-3-one);bis(2-tert-butyl-1-(4-methylphenyl)-1H-pyrrolo[3,4-c]pyridin-3-one);bis(2-tert-butyl-3-(4-methylphenyl)-3H-pyrrolo[3,4-c]pyridin-1-one);2-methyl-1-(4-methylphenyl)-1H-pyrrolo[3,4-c]pyridin-3-one;2-methyl-3-(4-methylphenyl)-3H-pyrrolo[3,4-c]pyridin-1-one
CID 161946162

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one?
The IUPAC name of 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one (CID 159888346) is 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one.
What is the SMILES notation for 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one?
The canonical SMILES for 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one is CC(C)(C)N1C(=O)CCC1c1ccc(Cl)cc1.CC(C)(C)N1C(=O)CCC1c1ccccc1.CC(C)(C)N1C(=O)CCC1c1ccccn1.CC(C)(C)N1C(=O)CCC1c1cccnc1.CC(C)(C)N1C(=O)c2ccccc2C1c1ccccc1.CN1CC(c2ccccc2)N(C(C)(C)C)C1=O.Cc1ccc(-n2c3ccccc3c(=O)n2C(C)(C)C)cc1.Cc1ccc(C2(O)c3ccccc3C(=O)N2C(C)(C)C)cc1.Cc1ccc(C2(O)c3ncccc3C(=O)N2C(C)(C)C)c(F)c1.Cc1ccc(C2CCC(=O)N2C(C)(C)C)c(F)c1.Cc1ccc(C2CCC(=O)N2C(C)(C)C)cc1.Cc1ccc(C2CCC(=O)N2C(C)(C)C)cc1.Cc1ccc(C2c3ccccc3C(=O)N2C(C)(C)C)cc1.Cc1ccc(N2CCC(=O)N2C(C)(C)C)cc1.
What is the InChIKey of 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one?
The InChIKey is NUKQMSFMTDAOPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2.C19H21NO.C18H19FN2O2.C18H20N2O.C18H19NO.C15H20FNO.2C15H21NO.C14H18ClNO.2C14H20N2O.C14H19NO.2C13H18N2O/c1-13-9-11-14(12-10-13)19(22)16-8-6-5-7-15(16)17(21)20(19)18(2,3)4;1-13-9-11-14(12-10-13)17-15-7-5-6-8-16(15)18(21)20(17)19(2,3)4;1-11-7-8-13(14(19)10-11)18(23)15-12(6-5-9-20-15)16(22)21(18)17(2,3)4;1-13-9-11-14(12-10-13)19-16-8-6-5-7-15(16)17(21)20(19)18(2,3)4;1-18(2,3)19-16(13-9-5-4-6-10-13)14-11-7-8-12-15(14)17(19)20;1-10-5-6-11(12(16)9-10)13-7-8-14(18)17(13)15(2,3)4;2*1-11-5-7-12(8-6-11)13-9-10-14(17)16(13)15(2,3)4;1-14(2,3)16-12(8-9-13(16)17)10-4-6-11(15)7-5-10;1-11-5-7-12(8-6-11)15-10-9-13(17)16(15)14(2,3)4;1-14(2,3)16-12(10-15(4)13(16)17)11-8-6-5-7-9-11;1-14(2,3)15-12(9-10-13(15)16)11-7-5-4-6-8-11;1-13(2,3)15-11(6-7-12(15)16)10-5-4-8-14-9-10;1-13(2,3)15-11(7-8-12(15)16)10-6-4-5-9-14-10/h5-12,22H,1-4H3;5-12,17H,1-4H3;5-10,23H,1-4H3;5-12H,1-4H3;4-12,16H,1-3H3;5-6,9,13H,7-8H2,1-4H3;2*5-8,13H,9-10H2,1-4H3;4-7,12H,8-9H2,1-3H3;5-8H,9-10H2,1-4H3;5-9,12H,10H2,1-4H3;4-8,12H,9-10H2,1-3H3;4-5,8-9,11H,6-7H2,1-3H3;4-6,9,11H,7-8H2,1-3H3.
What are the key properties of 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one?
1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one has a molecular weight of 3517.18 g/mol, XLogP of 46.83, 14 rotatable bonds, 2 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-5-(4-chlorophenyl)pyrrolidin-2-one;6-tert-butyl-7-(2-fluoro-4-methylphenyl)-7-hydroxypyrrolo[3,4-b]pyridin-5-one;1-tert-butyl-5-(2-fluoro-4-methylphenyl)pyrrolidin-2-one;2-tert-butyl-3-hydroxy-3-(4-methylphenyl)isoindol-1-one;3-tert-butyl-1-methyl-4-phenylimidazolidin-2-one;2-tert-butyl-1-(4-methylphenyl)indazol-3-one;2-tert-butyl-3-(4-methylphenyl)-3H-isoindol-1-one;2-tert-butyl-1-(4-methylphenyl)pyrazolidin-3-one;bis(1-tert-butyl-5-(4-methylphenyl)pyrrolidin-2-one);2-tert-butyl-3-phenyl-3H-isoindol-1-one;1-tert-butyl-5-phenylpyrrolidin-2-one;1-tert-butyl-5-pyridin-2-ylpyrrolidin-2-one;1-tert-butyl-5-pyridin-3-ylpyrrolidin-2-one is sourced from PubChem (CID 159888346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).