About 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate
4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate (PubChem CID 159292894) has the molecular formula C112H221N25O29
and a molecular weight of 2382.15 g/mol. Its IUPAC name is 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate.
Frequently Asked Questions
What is the IUPAC name of 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate?
The IUPAC name of 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate (CID 159292894) is 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate.
What is the SMILES notation for 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate?
The canonical SMILES for 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate is CCC(C)(C)N1CCOCC(NC)C1=O.CCN1CCOCC(NC)C1=O.CNC1COCCN(C(C)(C)C)C1=O.CNC1COCCN(C(C)C)C1=O.CNC1COCCN(C)C1=O.CNC1COCCN(CC(=O)OC)C1=O.CNC1COCCN(CC(C)(C)C)C1=O.CNC1COCCN(CC(C)=O)C1=O.CNC1COCCN(CC(C)C)C1=O.CNC1COCCN(CC(C)O)C1=O.CNC1COCCN(CCN(C)C)C1=O.CNC1COCCN(CCOC)C1=O.
What is the InChIKey of 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate?
The InChIKey is LAIRGLZDTFZOMX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H22N2O2.C10H21N3O2.2C10H20N2O2.C9H16N2O4.2C9H18N2O3.C9H16N2O3.C9H18N2O2.C8H16N2O2.C7H14N2O2/c1-11(2,3)8-13-5-6-15-7-9(12-4)10(13)14;1-5-11(2,3)13-6-7-15-8-9(12-4)10(13)14;1-11-9-8-15-7-6-13(10(9)14)5-4-12(2)3;1-10(2,3)12-5-6-14-7-8(11-4)9(12)13;1-8(2)6-12-4-5-14-7-9(11-3)10(12)13;1-10-7-6-15-4-3-11(9(7)13)5-8(12)14-2;1-10-8-7-14-6-4-11(9(8)12)3-5-13-2;2*1-7(12)5-11-3-4-14-6-8(10-2)9(11)13;1-7(2)11-4-5-13-6-8(10-3)9(11)12;1-3-10-4-5-12-6-7(9-2)8(10)11;1-8-6-5-11-4-3-9(2)7(6)10/h2*9,12H,5-8H2,1-4H3;9,11H,4-8H2,1-3H3;8,11H,5-7H2,1-4H3;8-9,11H,4-7H2,1-3H3;7,10H,3-6H2,1-2H3;8,10H,3-7H2,1-2H3;7-8,10,12H,3-6H2,1-2H3;8,10H,3-6H2,1-2H3;7-8,10H,4-6H2,1-3H3;7,9H,3-6H2,1-2H3;6,8H,3-5H2,1-2H3.
What are the key properties of 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate?
4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate has a molecular weight of 2382.15 g/mol, XLogP of -5.70, 31 rotatable bonds, 13 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-6-(methylamino)-1,4-oxazepan-5-one;4-[2-(dimethylamino)ethyl]-6-(methylamino)-1,4-oxazepan-5-one;4-(2,2-dimethylpropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-ethyl-6-(methylamino)-1,4-oxazepan-5-one;4-(2-hydroxypropyl)-6-(methylamino)-1,4-oxazepan-5-one;4-(2-methoxyethyl)-6-(methylamino)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylbutan-2-yl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-methylpropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-(2-oxopropyl)-1,4-oxazepan-5-one;6-(methylamino)-4-propan-2-yl-1,4-oxazepan-5-one;4-methyl-6-(methylamino)-1,4-oxazepan-5-one;methyl 2-[6-(methylamino)-5-oxo-1,4-oxazepan-4-yl]acetate is sourced from PubChem (CID 159292894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).