[4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one

C115H181F3N8O32 — CID 157093418

IUPAC[4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one
SMILESCC(=O)OC1CC(=O)N1C(=O)C1CC2CCC1C2.CCC(C)(C(=O)OC(C)C(=O)N1C(=O)CC1OC(C)=O)C(F)(F)F.CCC(C)(C)C(=O)N1C(=O)C(C)(C)C1(C)C.CCC(C)(C)C(=O)N1C(=O)CC1(C)C.CCC(C)(C)C(=O)OC.CCC(C)(C)C(=O)OC1CCC(C(=O)N2C(=O)CC2OC(C)=O)C1.CCC(C)(C)C(=O)OC1CCC(C(=O)N2C(=O)CC2OC(C)=O)CC1.CCC(C)C(=O)N1C(=O)C(C)(C)C1(C)C.CCC(C)C(=O)N1C(=O)CC1(C)C
InChIInChI=1S/C18H27NO6.C17H25NO6.C14H18F3NO6.C13H17NO4.C13H23NO2.C12H21NO2.C11H19NO2.C10H17NO2.C7H14O2/c1-5-18(3,4)17(23)25-13-8-6-12(7-9-13)16(22)19-14(21)10-15(19)24-11(2)20;1-5-17(3,4)16(22)24-12-7-6-11(8-12)15(21)18-13(20)9-14(18)23-10(2)19;1-5-13(4,14(15,16)17)12(22)23-7(2)11(21)18-9(20)6-10(18)24-8(3)19;1-7(15)18-12-6-11(16)14(12)13(17)10-5-8-2-3-9(10)4-8;1-8-11(2,3)9(15)14-10(16)12(4,5)13(14,6)7;1-7-8(2)9(14)13-10(15)11(3,4)12(13,5)6;1-6-10(2,3)9(14)12-8(13)7-11(12,4)5;1-5-7(2)9(13)11-8(12)6-10(11,3)4;1-5-7(2,3)6(8)9-4/h12-13,15H,5-10H2,1-4H3;11-12,14H,5-9H2,1-4H3;7,10H,5-6H2,1-4H3;8-10,12H,2-6H2,1H3;8H2,1-7H3;8H,7H2,1-6H3;6-7H2,1-5H3;7H,5-6H2,1-4H3;5H2,1-4H3
InChIKeyAEXUXMXDNSXJSB-UHFFFAOYSA-N
MW2244.73 g/mol
LogP16.50
Rot. Bonds27

About [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one

[4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one (PubChem CID 157093418) has the molecular formula C115H181F3N8O32 and a molecular weight of 2244.73 g/mol. Its IUPAC name is [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one.

Molecular Properties

Compound Name[4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one
PubChem CID157093418
Molecular FormulaC115H181F3N8O32
Molecular Weight2244.73 g/mol
Exact Mass2243.27
IUPAC Name[4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one
SMILESCC(=O)OC1CC(=O)N1C(=O)C1CC2CCC1C2.CCC(C)(C(=O)OC(C)C(=O)N1C(=O)CC1OC(C)=O)C(F)(F)F.CCC(C)(C)C(=O)N1C(=O)C(C)(C)C1(C)C.CCC(C)(C)C(=O)N1C(=O)CC1(C)C.CCC(C)(C)C(=O)OC.CCC(C)(C)C(=O)OC1CCC(C(=O)N2C(=O)CC2OC(C)=O)C1.CCC(C)(C)C(=O)OC1CCC(C(=O)N2C(=O)CC2OC(C)=O)CC1.CCC(C)C(=O)N1C(=O)C(C)(C)C1(C)C.CCC(C)C(=O)N1C(=O)CC1(C)C
InChIInChI=1S/C18H27NO6.C17H25NO6.C14H18F3NO6.C13H17NO4.C13H23NO2.C12H21NO2.C11H19NO2.C10H17NO2.C7H14O2/c1-5-18(3,4)17(23)25-13-8-6-12(7-9-13)16(22)19-14(21)10-15(19)24-11(2)20;1-5-17(3,4)16(22)24-12-7-6-11(8-12)15(21)18-13(20)9-14(18)23-10(2)19;1-5-13(4,14(15,16)17)12(22)23-7(2)11(21)18-9(20)6-10(18)24-8(3)19;1-7(15)18-12-6-11(16)14(12)13(17)10-5-8-2-3-9(10)4-8;1-8-11(2,3)9(15)14-10(16)12(4,5)13(14,6)7;1-7-8(2)9(14)13-10(15)11(3,4)12(13,5)6;1-6-10(2,3)9(14)12-8(13)7-11(12,4)5;1-5-7(2)9(13)11-8(12)6-10(11,3)4;1-5-7(2,3)6(8)9-4/h12-13,15H,5-10H2,1-4H3;11-12,14H,5-9H2,1-4H3;7,10H,5-6H2,1-4H3;8-10,12H,2-6H2,1H3;8H2,1-7H3;8H,7H2,1-6H3;6-7H2,1-5H3;7H,5-6H2,1-4H3;5H2,1-4H3
InChIKeyAEXUXMXDNSXJSB-UHFFFAOYSA-N
XLogP16.50
TPSA509.44 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds27
Heavy Atoms158
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002244.73
LogP ≤ 516.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one with MolForge

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Related Compounds

[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate
CID 67963938
[1-(2,2-dimethylbutanoyl)-4-oxoazetidin-2-yl] acetate;[1-(2,2-dimethylbutanoyl)-4-oxoazetidin-2-yl] 2-methylpropanoate;bis([1-(2-methylbutanoyl)-4-oxoazetidin-2-yl] acetate);[1-(2-methylbutanoyl)-4-oxoazetidin-2-yl] 2-methylpropanoate;bis([1-[2-methyl-2-(trifluoromethyl)butanoyl]-4-oxoazetidin-2-yl] acetate)
CID 158394278
[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-(trifluoromethyl)prop-2-enoate
CID 67963852
3-(bicyclo[2.2.1]heptane-2-carbonyl)-3-azatricyclo[4.2.1.02,5]nonan-4-one;methyl acetate;methyl 2-methylprop-2-enoate;[4-(10-oxo-9-azatetracyclo[5.4.1.02,6.08,11]dodecane-9-carbonyl)cyclohexyl] 2-methylprop-2-enoate;[2-oxo-2-(10-oxo-9-azatetracyclo[5.4.1.02,6.08,11]dodecan-9-yl)ethyl] 2-methylprop-2-enoate;bis([2-oxo-2-(4-oxo-3-azatricyclo[4.2.1.02,5]nonan-3-yl)ethyl] 2-methylprop-2-enoate);[1-oxo-1-(4-oxo-3-azatricyclo[4.2.1.02,5]nonan-3-yl)propan-2-yl] 2-methylprop-2-enoate
CID 157276240
bis(2-(2-bicyclo[2.2.1]heptanylmethyl)-1,1,1,3,3,3-hexafluoropropan-2-ol);2-[(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)methyl]-1,1,1,3,3,3-hexafluoropropan-2-ol;methane;methyl 2,2-dimethylbutanoate;methyl 2-methylbutanoate
CID 157372663
2-(2-bicyclo[2.2.1]heptanylmethyl)-1,1,1,3,3,3-hexafluoropropan-2-ol;butan-2-ylbenzene;(4-tert-butylcyclohexyl) 2,2-dimethylbutanoate;tert-butyl 2-methyl-2-(trifluoromethyl)butanoate;(5,6-dimethyl-2-bicyclo[2.2.1]heptanyl)methyl-trimethylsilane;2-(4-methylcyclohexyl)propan-2-yl 2,2-dimethylbutanoate;methyl 2,2-dimethylbutanoate;1,1,1-trifluoropropan-2-yl 2,2-dimethylbutanoate;2-trimethylsilylethyl 2,2-dimethylbutanoate;bis(3-trimethylsilylpropyl 2,2-dimethylbutanoate)
CID 161217410
bicyclo[2.2.1]heptane-2-carbonitrile;[3,5-bis(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)cyclohexyl] 2,2-dimethylbutanoate;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;3,4-dimethyloxolane-2,5-dione;bis([(1S,2R,6R,8S,9S)-4,4-dimethyl-10-oxo-3,5,7,11-tetraoxatricyclo[6.3.0.02,6]undecan-9-yl] 2,2-dimethylbutanoate);methyl 2,2-dimethylbutanoate;trimethyl(2-methylbutyl)silane
CID 161123975
1-adamantylmethyl 2-methyl-2-(trifluoromethyl)butanoate;(1,3,3,4,5,5,6,6,7,7-decafluoro-2-bicyclo[2.2.1]heptanyl) 2,2-dimethylbutanoate;(1,3,3,4,5,5,6,6,7,7-decafluoro-2-bicyclo[2.2.1]heptanyl) 2-methylbutanoate;(1,3,3,4,5,5,6,6,7,7-decafluoro-2-bicyclo[2.2.1]heptanyl) 2-methyl-2-(trifluoromethyl)butanoate
CID 123571644
2-(1-adamantyl)propan-2-yl 2-methylbutanoate;2-(2-bicyclo[2.2.1]heptanylmethyl)-1,1,1,3,3,3-hexafluoropropan-2-ol;(3,5-dihydroxy-1-adamantyl) 2,2-dimethylbutanoate;(2-ethyl-2-adamantyl) 2,2-dimethylbutanoate;(3-hydroxy-1-adamantyl) 2,2-dimethylbutanoate;(2-methyl-2-adamantyl) 2,2-dimethylbutanoate;methyl 2,2-dimethylbutanoate;(5-oxooxolan-3-yl) 2,2-dimethylbutanoate
CID 161095328
2-(2-bicyclo[2.2.1]heptanylmethyl)-1,1,1,3,3-pentafluoropropan-2-ol;methyl 2,2-dimethylbutanoate
CID 91160976
[3-[2-(2,2-dimethylbutanoyloxy)ethoxy]-1,1,2,2-tetrafluoro-3-oxopropyl] bicyclo[2.2.1]heptane-2-carboxylate
CID 129190166
[1-(2,2-dimethylbutanoyl)-4-oxoazetidin-2-yl] butanoate
CID 67963920

Frequently Asked Questions

What is the IUPAC name of [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one?
The IUPAC name of [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one (CID 157093418) is [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one.
What is the SMILES notation for [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one?
The canonical SMILES for [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one is CC(=O)OC1CC(=O)N1C(=O)C1CC2CCC1C2.CCC(C)(C(=O)OC(C)C(=O)N1C(=O)CC1OC(C)=O)C(F)(F)F.CCC(C)(C)C(=O)N1C(=O)C(C)(C)C1(C)C.CCC(C)(C)C(=O)N1C(=O)CC1(C)C.CCC(C)(C)C(=O)OC.CCC(C)(C)C(=O)OC1CCC(C(=O)N2C(=O)CC2OC(C)=O)C1.CCC(C)(C)C(=O)OC1CCC(C(=O)N2C(=O)CC2OC(C)=O)CC1.CCC(C)C(=O)N1C(=O)C(C)(C)C1(C)C.CCC(C)C(=O)N1C(=O)CC1(C)C.
What is the InChIKey of [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one?
The InChIKey is AEXUXMXDNSXJSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO6.C17H25NO6.C14H18F3NO6.C13H17NO4.C13H23NO2.C12H21NO2.C11H19NO2.C10H17NO2.C7H14O2/c1-5-18(3,4)17(23)25-13-8-6-12(7-9-13)16(22)19-14(21)10-15(19)24-11(2)20;1-5-17(3,4)16(22)24-12-7-6-11(8-12)15(21)18-13(20)9-14(18)23-10(2)19;1-5-13(4,14(15,16)17)12(22)23-7(2)11(21)18-9(20)6-10(18)24-8(3)19;1-7(15)18-12-6-11(16)14(12)13(17)10-5-8-2-3-9(10)4-8;1-8-11(2,3)9(15)14-10(16)12(4,5)13(14,6)7;1-7-8(2)9(14)13-10(15)11(3,4)12(13,5)6;1-6-10(2,3)9(14)12-8(13)7-11(12,4)5;1-5-7(2)9(13)11-8(12)6-10(11,3)4;1-5-7(2,3)6(8)9-4/h12-13,15H,5-10H2,1-4H3;11-12,14H,5-9H2,1-4H3;7,10H,5-6H2,1-4H3;8-10,12H,2-6H2,1H3;8H2,1-7H3;8H,7H2,1-6H3;6-7H2,1-5H3;7H,5-6H2,1-4H3;5H2,1-4H3.
What are the key properties of [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one?
[4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one has a molecular weight of 2244.73 g/mol, XLogP of 16.50, 27 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclohexyl] 2,2-dimethylbutanoate;[3-(2-acetyloxy-4-oxoazetidine-1-carbonyl)cyclopentyl] 2,2-dimethylbutanoate;[1-(2-acetyloxy-4-oxoazetidin-1-yl)-1-oxopropan-2-yl] 2-methyl-2-(trifluoromethyl)butanoate;[1-(bicyclo[2.2.1]heptane-2-carbonyl)-4-oxoazetidin-2-yl] acetate;1-(2,2-dimethylbutanoyl)-4,4-dimethylazetidin-2-one;1-(2,2-dimethylbutanoyl)-3,3,4,4-tetramethylazetidin-2-one;4,4-dimethyl-1-(2-methylbutanoyl)azetidin-2-one;methyl 2,2-dimethylbutanoate;3,3,4,4-tetramethyl-1-(2-methylbutanoyl)azetidin-2-one is sourced from PubChem (CID 157093418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).