3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione

C160H195N27O29 — CID 167660469

IUPAC3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
SMILESCn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(C#CC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(C(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(CC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(CC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(OC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(C#CC(C)(C)C)c21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(C(C)(C)C)c21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(CC(C)(C)C)c21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(OC(C)(C)C)c21
InChIInChI=1S/2C19H21N3O3.3C18H23N3O3.2C17H21N3O4.2C17H21N3O3/c1-19(2,3)10-9-12-5-6-13-15(11-12)21(4)18(25)22(13)14-7-8-16(23)20-17(14)24;1-19(2,3)11-10-12-6-5-7-13-16(12)21(4)18(25)22(13)14-8-9-15(23)20-17(14)24;2*1-18(2,3)10-11-5-6-12-14(9-11)20(4)17(24)21(12)13-7-8-15(22)19-16(13)23;1-18(2,3)10-11-6-5-7-12-15(11)20(4)17(24)21(12)13-8-9-14(22)19-16(13)23;1-17(2,3)24-10-5-6-11-13(9-10)19(4)16(23)20(11)12-7-8-14(21)18-15(12)22;1-17(2,3)24-12-7-5-6-10-14(12)19(4)16(23)20(10)11-8-9-13(21)18-15(11)22;1-17(2,3)10-5-6-11-13(9-10)19(4)16(23)20(11)12-7-8-14(21)18-15(12)22;1-17(2,3)10-6-5-7-11-14(10)19(4)16(23)20(11)12-8-9-13(21)18-15(12)22/h5-6,11,14H,7-8H2,1-4H3,(H,20,23,24);5-7,14H,8-9H2,1-4H3,(H,20,23,24);2*5-6,9,13H,7-8,10H2,1-4H3,(H,19,22,23);5-7,13H,8-10H2,1-4H3,(H,19,22,23);5-6,9,12H,7-8H2,1-4H3,(H,18,21,22);5-7,11H,8-9H2,1-4H3,(H,18,21,22);5-6,9,12H,7-8H2,1-4H3,(H,18,21,22);5-7,12H,8-9H2,1-4H3,(H,18,21,22)
InChIKeyRWQOQANOQQWWFT-UHFFFAOYSA-N
MW2960.48 g/mol
LogP15.37
Rot. Bonds14

About 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione

3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione (PubChem CID 167660469) has the molecular formula C160H195N27O29 and a molecular weight of 2960.48 g/mol. Its IUPAC name is 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione.

Molecular Properties

Compound Name3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
PubChem CID167660469
Molecular FormulaC160H195N27O29
Molecular Weight2960.48 g/mol
Exact Mass2958.46
IUPAC Name3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
SMILESCn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(C#CC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(C(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(CC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(CC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(OC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(C#CC(C)(C)C)c21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(C(C)(C)C)c21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(CC(C)(C)C)c21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(OC(C)(C)C)c21
InChIInChI=1S/2C19H21N3O3.3C18H23N3O3.2C17H21N3O4.2C17H21N3O3/c1-19(2,3)10-9-12-5-6-13-15(11-12)21(4)18(25)22(13)14-7-8-16(23)20-17(14)24;1-19(2,3)11-10-12-6-5-7-13-16(12)21(4)18(25)22(13)14-8-9-15(23)20-17(14)24;2*1-18(2,3)10-11-5-6-12-14(9-11)20(4)17(24)21(12)13-7-8-15(22)19-16(13)23;1-18(2,3)10-11-6-5-7-12-15(11)20(4)17(24)21(12)13-8-9-14(22)19-16(13)23;1-17(2,3)24-10-5-6-11-13(9-10)19(4)16(23)20(11)12-7-8-14(21)18-15(12)22;1-17(2,3)24-12-7-5-6-10-14(12)19(4)16(23)20(10)11-8-9-13(21)18-15(11)22;1-17(2,3)10-5-6-11-13(9-10)19(4)16(23)20(11)12-7-8-14(21)18-15(12)22;1-17(2,3)10-6-5-7-11-14(10)19(4)16(23)20(11)12-8-9-13(21)18-15(12)22/h5-6,11,14H,7-8H2,1-4H3,(H,20,23,24);5-7,14H,8-9H2,1-4H3,(H,20,23,24);2*5-6,9,13H,7-8,10H2,1-4H3,(H,19,22,23);5-7,13H,8-10H2,1-4H3,(H,19,22,23);5-6,9,12H,7-8H2,1-4H3,(H,18,21,22);5-7,11H,8-9H2,1-4H3,(H,18,21,22);5-6,9,12H,7-8H2,1-4H3,(H,18,21,22);5-7,12H,8-9H2,1-4H3,(H,18,21,22)
InChIKeyRWQOQANOQQWWFT-UHFFFAOYSA-N
XLogP15.37
TPSA676.36 Ų
H-Bond Donors9
H-Bond Acceptors47
Rotatable Bonds14
Heavy Atoms216
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002960.48
LogP ≤ 515.37
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1047

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione 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

3-[4-(Tert-butylamino)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
CID 161943474
3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[(5S)-5-(2-tert-butylphenyl)-2-oxo-1,3-oxazolidin-3-yl]piperidine-2,6-dione;3-[(5S)-5-(3-tert-butylphenyl)-2-oxo-1,3-oxazolidin-3-yl]piperidine-2,6-dione;3-[(5S)-5-(4-tert-butylphenyl)-2-oxo-1,3-oxazolidin-3-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
CID 162203895
3-[4-(Tert-butylamino)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-(2-methylpropyl)-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
CID 162207788
3-[4-(tert-butylamino)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-(3-tert-butyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(4-tert-butyl-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-oxo-1H-isoindol-2-yl)piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
CID 163449040
3-(4-Tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
CID 163597674
3-(4-Tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
CID 164160688
1-(6-methylidene-2-oxopiperidin-3-yl)-3-propan-2-ylbenzimidazol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-6-propan-2-yl-1,3-benzoxazol-2-one;3-(6-methylidene-2-oxopiperidin-3-yl)-7-propan-2-yl-1,3-benzoxazol-2-one;1-methyl-3-(6-methylidene-2-oxopiperidin-3-yl)-5-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3S)-6-methylidene-2-oxopiperidin-3-yl]-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3R)-6-methylidene-2-oxopiperidin-3-yl]-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3S)-6-methylidene-2-oxopiperidin-3-yl]-5-propan-2-ylbenzimidazol-2-one;3-methyl-1-[(3R)-6-methylidene-2-oxopiperidin-3-yl]-5-propan-2-ylbenzimidazol-2-one;3-methyl-1-(6-methylidene-2-oxopiperidin-3-yl)-4-propan-2-ylbenzimidazol-2-one;3-methyl-1-(6-methylidene-2-oxopiperidin-3-yl)-5-propan-2-ylbenzimidazol-2-one
CID 167600021
3-[4-(Tert-butylamino)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(3-tert-butyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione
CID 167671995

Frequently Asked Questions

What is the IUPAC name of 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione?
The IUPAC name of 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione (CID 167660469) is 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione.
What is the SMILES notation for 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione?
The canonical SMILES for 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione is Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(C#CC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(C(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(CC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(CC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(OC(C)(C)C)cc21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(C#CC(C)(C)C)c21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(C(C)(C)C)c21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(CC(C)(C)C)c21.Cn1c(=O)n(C2CCC(=O)NC2=O)c2cccc(OC(C)(C)C)c21.
What is the InChIKey of 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione?
The InChIKey is RWQOQANOQQWWFT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H21N3O3.3C18H23N3O3.2C17H21N3O4.2C17H21N3O3/c1-19(2,3)10-9-12-5-6-13-15(11-12)21(4)18(25)22(13)14-7-8-16(23)20-17(14)24;1-19(2,3)11-10-12-6-5-7-13-16(12)21(4)18(25)22(13)14-8-9-15(23)20-17(14)24;2*1-18(2,3)10-11-5-6-12-14(9-11)20(4)17(24)21(12)13-7-8-15(22)19-16(13)23;1-18(2,3)10-11-6-5-7-12-15(11)20(4)17(24)21(12)13-8-9-14(22)19-16(13)23;1-17(2,3)24-10-5-6-11-13(9-10)19(4)16(23)20(11)12-7-8-14(21)18-15(12)22;1-17(2,3)24-12-7-5-6-10-14(12)19(4)16(23)20(10)11-8-9-13(21)18-15(11)22;1-17(2,3)10-5-6-11-13(9-10)19(4)16(23)20(11)12-7-8-14(21)18-15(12)22;1-17(2,3)10-6-5-7-11-14(10)19(4)16(23)20(11)12-8-9-13(21)18-15(12)22/h5-6,11,14H,7-8H2,1-4H3,(H,20,23,24);5-7,14H,8-9H2,1-4H3,(H,20,23,24);2*5-6,9,13H,7-8,10H2,1-4H3,(H,19,22,23);5-7,13H,8-10H2,1-4H3,(H,19,22,23);5-6,9,12H,7-8H2,1-4H3,(H,18,21,22);5-7,11H,8-9H2,1-4H3,(H,18,21,22);5-6,9,12H,7-8H2,1-4H3,(H,18,21,22);5-7,12H,8-9H2,1-4H3,(H,18,21,22).
What are the key properties of 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione?
3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione has a molecular weight of 2960.48 g/mol, XLogP of 15.37, 14 rotatable bonds, 9 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-(5-tert-butyl-3-methyl-2-oxobenzimidazol-1-yl)piperidine-2,6-dione;3-[4-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[5-(3,3-dimethylbut-1-ynyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[4-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;bis(3-[5-(2,2-dimethylpropyl)-3-methyl-2-oxobenzimidazol-1-yl]piperidine-2,6-dione);3-[3-methyl-4-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione;3-[3-methyl-5-[(2-methylpropan-2-yl)oxy]-2-oxobenzimidazol-1-yl]piperidine-2,6-dione is sourced from PubChem (CID 167660469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).