1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione

C139H184N30O28S3 — CID 157438778

IUPAC1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione
SMILESCC1(C)CC(=O)N(CCc2cnc[nH]2)C(=O)C1.CC1CC(=O)N(CCc2cnc[nH]2)C(=O)C1.Cn1cccc1CCN1C(=O)CCCC1=O.Cn1cnc(CCN2C(=O)CCCC2=O)c1.O=C1CCCC(=O)N1CCC1=CN=CC1.O=C1CCCC(=O)N1CCC1=NC=CC1.O=C1CCCC(=O)N1CCC1=NCCN1.O=C1CCCC(=O)N1CCC1CCCN1.O=C1CCCC(=O)N1CCc1ccns1.O=C1CCCC(=O)N1CCc1ccsc1.O=C1CCCC(=O)N1CCc1cnon1.O=C1CCCC(=O)N1CCc1ncco1.O=C1CCCC(=O)N1CCc1nccs1
InChIInChI=1S/C12H17N3O2.C12H16N2O2.2C11H15N3O2.C11H18N2O2.2C11H14N2O2.C11H13NO2S.C10H15N3O2.C10H12N2O3.2C10H12N2O2S.C9H11N3O3/c1-12(2)5-10(16)15(11(17)6-12)4-3-9-7-13-8-14-9;1-13-8-3-4-10(13)7-9-14-11(15)5-2-6-12(14)16;1-8-4-10(15)14(11(16)5-8)3-2-9-6-12-7-13-9;1-13-7-9(12-8-13)5-6-14-10(15)3-2-4-11(14)16;2*14-10-4-1-5-11(15)13(10)8-6-9-3-2-7-12-9;14-10-2-1-3-11(15)13(10)7-5-9-4-6-12-8-9;13-10-2-1-3-11(14)12(10)6-4-9-5-7-15-8-9;14-9-2-1-3-10(15)13(9)7-4-8-11-5-6-12-8;2*13-9-2-1-3-10(14)12(9)6-4-8-11-5-7-15-8;13-9-2-1-3-10(14)12(9)7-5-8-4-6-11-15-8;13-8-2-1-3-9(14)12(8)5-4-7-6-10-15-11-7/h7-8H,3-6H2,1-2H3,(H,13,14);3-4,8H,2,5-7,9H2,1H3;6-8H,2-5H2,1H3,(H,12,13);7-8H,2-6H2,1H3;9,12H,1-8H2;2,7H,1,3-6,8H2;6,8H,1-5,7H2;5,7-8H,1-4,6H2;1-7H2,(H,11,12);2*5,7H,1-4,6H2;4,6H,1-3,5,7H2;6H,1-5H2
InChIKeyBRKNQLICJOPULT-UHFFFAOYSA-N
MW2819.38 g/mol
LogP11.79
Rot. Bonds39

About 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione

1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione (PubChem CID 157438778) has the molecular formula C139H184N30O28S3 and a molecular weight of 2819.38 g/mol. Its IUPAC name is 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione.

Molecular Properties

Compound Name1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione
PubChem CID157438778
Molecular FormulaC139H184N30O28S3
Molecular Weight2819.38 g/mol
Exact Mass2817.31
IUPAC Name1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione
SMILESCC1(C)CC(=O)N(CCc2cnc[nH]2)C(=O)C1.CC1CC(=O)N(CCc2cnc[nH]2)C(=O)C1.Cn1cccc1CCN1C(=O)CCCC1=O.Cn1cnc(CCN2C(=O)CCCC2=O)c1.O=C1CCCC(=O)N1CCC1=CN=CC1.O=C1CCCC(=O)N1CCC1=NC=CC1.O=C1CCCC(=O)N1CCC1=NCCN1.O=C1CCCC(=O)N1CCC1CCCN1.O=C1CCCC(=O)N1CCc1ccns1.O=C1CCCC(=O)N1CCc1ccsc1.O=C1CCCC(=O)N1CCc1cnon1.O=C1CCCC(=O)N1CCc1ncco1.O=C1CCCC(=O)N1CCc1nccs1
InChIInChI=1S/C12H17N3O2.C12H16N2O2.2C11H15N3O2.C11H18N2O2.2C11H14N2O2.C11H13NO2S.C10H15N3O2.C10H12N2O3.2C10H12N2O2S.C9H11N3O3/c1-12(2)5-10(16)15(11(17)6-12)4-3-9-7-13-8-14-9;1-13-8-3-4-10(13)7-9-14-11(15)5-2-6-12(14)16;1-8-4-10(15)14(11(16)5-8)3-2-9-6-12-7-13-9;1-13-7-9(12-8-13)5-6-14-10(15)3-2-4-11(14)16;2*14-10-4-1-5-11(15)13(10)8-6-9-3-2-7-12-9;14-10-2-1-3-11(15)13(10)7-5-9-4-6-12-8-9;13-10-2-1-3-11(14)12(10)6-4-9-5-7-15-8-9;14-9-2-1-3-10(15)13(9)7-4-8-11-5-6-12-8;2*13-9-2-1-3-10(14)12(9)6-4-8-11-5-7-15-8;13-9-2-1-3-10(14)12(9)7-5-8-4-6-11-15-8;13-8-2-1-3-9(14)12(8)5-4-7-6-10-15-11-7/h7-8H,3-6H2,1-2H3,(H,13,14);3-4,8H,2,5-7,9H2,1H3;6-8H,2-5H2,1H3,(H,12,13);7-8H,2-6H2,1H3;9,12H,1-8H2;2,7H,1,3-6,8H2;6,8H,1-5,7H2;5,7-8H,1-4,6H2;1-7H2,(H,11,12);2*5,7H,1-4,6H2;4,6H,1-3,5,7H2;6H,1-5H2
InChIKeyBRKNQLICJOPULT-UHFFFAOYSA-N
XLogP11.79
TPSA717.92 Ų
H-Bond Donors4
H-Bond Acceptors46
Rotatable Bonds39
Heavy Atoms200
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002819.38
LogP ≤ 511.79
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1046

Computed Properties (RDKit)

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

Analyze 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)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

3,3-difluoro-1-methylpyrrolidine;1,3-dimethylazetidine;1,4-dimethylcyclohexane;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;1,4-dimethylpiperazine;1,3-dimethylpiperidine;1,4-dimethylpiperidine;1,2-dimethylpyrrolidine;1,3-dimethylpyrrolidine;2,4-dimethyl-1,3-thiazole;3-fluoro-1-methylpyrrolidine;1-methylazetidine;1-methylimidazole;2-methyl-1H-imidazole;4-methylmorpholine;2-methyl-1,3-oxazole;1-methylpiperidine;2-methylpyridine;4-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;toluene;N,N,4-trimethylcyclohexan-1-amine;2,4,6-trimethylpyridine;1,3,3-trimethylpyrrolidine
CID 157790631
3,3-difluoro-1-methylpyrrolidine;1,3-dimethylazetidine;1,4-dimethylcyclohexane;1,2-dimethylimidazole;1,5-dimethylimidazole;1,4-dimethylpiperazine;1,3-dimethylpiperidine;1,4-dimethylpiperidine;1,3-dimethylpyrrole;1,2-dimethylpyrrolidine;1,3-dimethylpyrrolidine;2,4-dimethyl-1,3-thiazole;3-fluoro-1-methylpyrrolidine;1-methylazetidine;1-methylimidazole;2-methyl-1H-imidazole;4-methylmorpholine;2-methyl-1,3-oxazole;1-methylpiperidine;2-methylpyridine;4-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;toluene;N,N,4-trimethylcyclohexan-1-amine;2,4,6-trimethylpyridine;1,3,3-trimethylpyrrolidine
CID 160631338
1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-3,3-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-(3-imidazol-1-ylpropyl)piperidine-2,6-dione;1-[2-(1-methylpyrrolidin-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-1-ylethyl)piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione
CID 157305776
1,4-dimethylcyclohexane;1,2-dimethylimidazole;1,4-dimethylimidazole;1,5-dimethylimidazole;2,4-dimethyl-1,3-thiazole;methylcyclopentane;2-methyl-1H-imidazole;4-methylmorpholine;2-methyl-1,3-oxazole;1-methylpiperidine;2-methylpyridine;4-methylpyridine;1-methylpyrrolidine;2-methyl-1,3-thiazole;2,4,6-trimethylpyridine
CID 159485733
1-(1H-imidazol-5-yl)-N,N-bis(1H-imidazol-5-ylmethyl)methanamine;1-(1-methylimidazol-2-yl)-N,N-bis[(1-methylimidazol-2-yl)methyl]methanamine;1-(1-methylimidazol-4-yl)-N,N-bis[(1-methylimidazol-4-yl)methyl]methanamine;1-(1,3-oxazol-2-yl)-N,N-bis(1,3-oxazol-2-ylmethyl)methanamine;1-(1,3-oxazol-4-yl)-N,N-bis(1,3-oxazol-4-ylmethyl)methanamine;1-pyrazin-2-yl-N,N-bis(pyrazin-2-ylmethyl)methanamine;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine;1-pyrimidin-2-yl-N,N-bis(pyrimidin-2-ylmethyl)methanamine;1-pyrimidin-4-yl-N,N-bis(pyrimidin-4-ylmethyl)methanamine;1-(3H-pyrrol-2-yl)-N,N-bis(3H-pyrrol-2-ylmethyl)methanamine;1-(1,3-thiazol-2-yl)-N,N-bis(1,3-thiazol-2-ylmethyl)methanamine;1-(1,3-thiazol-4-yl)-N,N-bis(1,3-thiazol-4-ylmethyl)methanamine;1-(1,3,5-triazin-2-yl)-N,N-bis(1,3,5-triazin-2-ylmethyl)methanamine
CID 160557967

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione?
The IUPAC name of 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione (CID 157438778) is 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione.
What is the SMILES notation for 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione?
The canonical SMILES for 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione is CC1(C)CC(=O)N(CCc2cnc[nH]2)C(=O)C1.CC1CC(=O)N(CCc2cnc[nH]2)C(=O)C1.Cn1cccc1CCN1C(=O)CCCC1=O.Cn1cnc(CCN2C(=O)CCCC2=O)c1.O=C1CCCC(=O)N1CCC1=CN=CC1.O=C1CCCC(=O)N1CCC1=NC=CC1.O=C1CCCC(=O)N1CCC1=NCCN1.O=C1CCCC(=O)N1CCC1CCCN1.O=C1CCCC(=O)N1CCc1ccns1.O=C1CCCC(=O)N1CCc1ccsc1.O=C1CCCC(=O)N1CCc1cnon1.O=C1CCCC(=O)N1CCc1ncco1.O=C1CCCC(=O)N1CCc1nccs1.
What is the InChIKey of 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione?
The InChIKey is BRKNQLICJOPULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2.C12H16N2O2.2C11H15N3O2.C11H18N2O2.2C11H14N2O2.C11H13NO2S.C10H15N3O2.C10H12N2O3.2C10H12N2O2S.C9H11N3O3/c1-12(2)5-10(16)15(11(17)6-12)4-3-9-7-13-8-14-9;1-13-8-3-4-10(13)7-9-14-11(15)5-2-6-12(14)16;1-8-4-10(15)14(11(16)5-8)3-2-9-6-12-7-13-9;1-13-7-9(12-8-13)5-6-14-10(15)3-2-4-11(14)16;2*14-10-4-1-5-11(15)13(10)8-6-9-3-2-7-12-9;14-10-2-1-3-11(15)13(10)7-5-9-4-6-12-8-9;13-10-2-1-3-11(14)12(10)6-4-9-5-7-15-8-9;14-9-2-1-3-10(15)13(9)7-4-8-11-5-6-12-8;2*13-9-2-1-3-10(14)12(9)6-4-8-11-5-7-15-8;13-9-2-1-3-10(14)12(9)7-5-8-4-6-11-15-8;13-8-2-1-3-9(14)12(8)5-4-7-6-10-15-11-7/h7-8H,3-6H2,1-2H3,(H,13,14);3-4,8H,2,5-7,9H2,1H3;6-8H,2-5H2,1H3,(H,12,13);7-8H,2-6H2,1H3;9,12H,1-8H2;2,7H,1,3-6,8H2;6,8H,1-5,7H2;5,7-8H,1-4,6H2;1-7H2,(H,11,12);2*5,7H,1-4,6H2;4,6H,1-3,5,7H2;6H,1-5H2.
What are the key properties of 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione?
1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione has a molecular weight of 2819.38 g/mol, XLogP of 11.79, 39 rotatable bonds, 4 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4,5-dihydro-1H-imidazol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4,4-dimethylpiperidine-2,6-dione;1-[2-(1H-imidazol-5-yl)ethyl]-4-methylpiperidine-2,6-dione;1-[2-(1-methylimidazol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1-methylpyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2,5-oxadiazol-3-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-oxazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-pyrrolidin-2-ylethyl)piperidine-2,6-dione;1-[2-(3H-pyrrol-2-yl)ethyl]piperidine-2,6-dione;1-[2-(3H-pyrrol-4-yl)ethyl]piperidine-2,6-dione;1-[2-(1,2-thiazol-5-yl)ethyl]piperidine-2,6-dione;1-[2-(1,3-thiazol-2-yl)ethyl]piperidine-2,6-dione;1-(2-thiophen-3-ylethyl)piperidine-2,6-dione is sourced from PubChem (CID 157438778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).