1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane

C248H488N36O24S — CID 161370312

IUPAC1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C=C(CO)N1CCC2(CCN(C(C)C)C2)C1.CC(C)(C)N1CCC2(CCCN(C(=O)CO)C2)C1.CC(C)(C)N1CCC2(CCN(C(=O)CO)CC2)C1.CC(C)C1CCC2(CCCCN2C(=O)CO)C1.CC(C)C1NCCC12CCN(C(=O)CO)CC2.CC(C)N1C(=O)CN2CCC1CC2.CC(C)N1C2CCC1CNC2.CC(C)N1C2CNCC1C2.CC(C)N1CC2CC1CN2.CC(C)N1CC2CC1CO2.CC(C)N1CC2CC1CS2.CC(C)N1CC2CCC(C1)O2.CC(C)N1CC2CCC(C2)C1.CC(C)N1CCC2(CC1)CC(=O)N(C(=O)CO)C2.CC(C)N1CCC2(CCCN2C(=O)CO)C1.CC(C)N1CCC2(CCN(C(=O)CO)C2)CC1=O.CC(C)N1CCCC2(CCN(C(=O)CO)C2)C1.CC12CC1CN(C(C)(C)C)C2.CN(C)C12CC1CN(C(C)(C)C)C2.CN(C)C1C2CN(C(C)(C)C)CC21.COC(=O)CN1CCC2(CCCCN2C(C)(C)C)C1
InChIInChI=1S/C15H28N2O2.2C14H26N2O2.C14H25NO2.2C13H22N2O3.2C13H24N2O2.C13H24N2O.C12H22N2O2.2C11H22N2.C10H18N2O.2C10H19N.C9H18N2.C9H17NO.2C8H16N2.C8H15NO.C8H15NS.12CH4/c1-14(2,3)17-9-6-5-7-15(17)8-10-16(12-15)11-13(18)19-4;1-13(2,3)16-9-6-14(11-16)4-7-15(8-5-14)12(18)10-17;1-13(2,3)16-8-6-14(11-16)5-4-7-15(10-14)12(18)9-17;1-11(2)12-5-7-14(9-12)6-3-4-8-15(14)13(17)10-16;1-10(2)15-6-4-13(7-11(15)17)3-5-14(9-13)12(18)8-16;1-10(2)14-5-3-13(4-6-14)7-11(17)15(9-13)12(18)8-16;1-10(2)12-13(3-6-14-12)4-7-15(8-5-13)11(17)9-16;1-11(2)14-6-3-4-13(9-14)5-7-15(10-13)12(17)8-16;1-11(2)14-6-4-13(9-14)5-7-15(10-13)12(3)8-16;1-10(2)13-7-5-12(9-13)4-3-6-14(12)11(16)8-15;1-10(2,3)13-7-9-6-11(9,8-13)12(4)5;1-11(2,3)13-6-8-9(7-13)10(8)12(4)5;1-8(2)12-9-3-5-11(6-4-9)7-10(12)13;1-9(2,3)11-6-8-5-10(8,4)7-11;1-8(2)11-6-9-3-4-10(5-9)7-11;1-7(2)11-8-3-4-9(11)6-10-5-8;1-7(2)10-5-8-3-4-9(6-10)11-8;1-6(2)10-5-7-3-8(10)4-9-7;1-6(2)10-7-3-8(10)5-9-4-7;2*1-6(2)9-4-8-3-7(9)5-10-8;;;;;;;;;;;;/h5-12H2,1-4H3;2*17H,4-11H2,1-3H3;11-12,16H,3-10H2,1-2H3;2*10,16H,3-9H2,1-2H3;10,12,14,16H,3-9H2,1-2H3;11,16H,3-10H2,1-2H3;11,16H,3-10H2,1-2H3;10,15H,3-9H2,1-2H3;9H,6-8H2,1-5H3;8-10H,6-7H2,1-5H3;8-9H,3-7H2,1-2H3;8H,5-7H2,1-4H3;8-10H,3-7H2,1-2H3;7-10H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;2*6-9H,3-5H2,1-2H3;2*6-8H,3-5H2,1-2H3;12*1H4
InChIKeyVQJKYIJVSFVBOV-UHFFFAOYSA-N
MW4390.93 g/mol
LogP30.48
Rot. Bonds29

About 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane

1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane (PubChem CID 161370312) has the molecular formula C248H488N36O24S and a molecular weight of 4390.93 g/mol. Its IUPAC name is 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane.

Molecular Properties

Compound Name1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane
PubChem CID161370312
Molecular FormulaC248H488N36O24S
Molecular Weight4390.93 g/mol
Exact Mass4387.78
IUPAC Name1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C=C(CO)N1CCC2(CCN(C(C)C)C2)C1.CC(C)(C)N1CCC2(CCCN(C(=O)CO)C2)C1.CC(C)(C)N1CCC2(CCN(C(=O)CO)CC2)C1.CC(C)C1CCC2(CCCCN2C(=O)CO)C1.CC(C)C1NCCC12CCN(C(=O)CO)CC2.CC(C)N1C(=O)CN2CCC1CC2.CC(C)N1C2CCC1CNC2.CC(C)N1C2CNCC1C2.CC(C)N1CC2CC1CN2.CC(C)N1CC2CC1CO2.CC(C)N1CC2CC1CS2.CC(C)N1CC2CCC(C1)O2.CC(C)N1CC2CCC(C2)C1.CC(C)N1CCC2(CC1)CC(=O)N(C(=O)CO)C2.CC(C)N1CCC2(CCCN2C(=O)CO)C1.CC(C)N1CCC2(CCN(C(=O)CO)C2)CC1=O.CC(C)N1CCCC2(CCN(C(=O)CO)C2)C1.CC12CC1CN(C(C)(C)C)C2.CN(C)C12CC1CN(C(C)(C)C)C2.CN(C)C1C2CN(C(C)(C)C)CC21.COC(=O)CN1CCC2(CCCCN2C(C)(C)C)C1
InChIInChI=1S/C15H28N2O2.2C14H26N2O2.C14H25NO2.2C13H22N2O3.2C13H24N2O2.C13H24N2O.C12H22N2O2.2C11H22N2.C10H18N2O.2C10H19N.C9H18N2.C9H17NO.2C8H16N2.C8H15NO.C8H15NS.12CH4/c1-14(2,3)17-9-6-5-7-15(17)8-10-16(12-15)11-13(18)19-4;1-13(2,3)16-9-6-14(11-16)4-7-15(8-5-14)12(18)10-17;1-13(2,3)16-8-6-14(11-16)5-4-7-15(10-14)12(18)9-17;1-11(2)12-5-7-14(9-12)6-3-4-8-15(14)13(17)10-16;1-10(2)15-6-4-13(7-11(15)17)3-5-14(9-13)12(18)8-16;1-10(2)14-5-3-13(4-6-14)7-11(17)15(9-13)12(18)8-16;1-10(2)12-13(3-6-14-12)4-7-15(8-5-13)11(17)9-16;1-11(2)14-6-3-4-13(9-14)5-7-15(10-13)12(17)8-16;1-11(2)14-6-4-13(9-14)5-7-15(10-13)12(3)8-16;1-10(2)13-7-5-12(9-13)4-3-6-14(12)11(16)8-15;1-10(2,3)13-7-9-6-11(9,8-13)12(4)5;1-11(2,3)13-6-8-9(7-13)10(8)12(4)5;1-8(2)12-9-3-5-11(6-4-9)7-10(12)13;1-9(2,3)11-6-8-5-10(8,4)7-11;1-8(2)11-6-9-3-4-10(5-9)7-11;1-7(2)11-8-3-4-9(11)6-10-5-8;1-7(2)10-5-8-3-4-9(6-10)11-8;1-6(2)10-5-7-3-8(10)4-9-7;1-6(2)10-7-3-8(10)5-9-4-7;2*1-6(2)9-4-8-3-7(9)5-10-8;;;;;;;;;;;;/h5-12H2,1-4H3;2*17H,4-11H2,1-3H3;11-12,16H,3-10H2,1-2H3;2*10,16H,3-9H2,1-2H3;10,12,14,16H,3-9H2,1-2H3;11,16H,3-10H2,1-2H3;11,16H,3-10H2,1-2H3;10,15H,3-9H2,1-2H3;9H,6-8H2,1-5H3;8-10H,6-7H2,1-5H3;8-9H,3-7H2,1-2H3;8H,5-7H2,1-4H3;8-10H,3-7H2,1-2H3;7-10H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;2*6-9H,3-5H2,1-2H3;2*6-8H,3-5H2,1-2H3;12*1H4
InChIKeyVQJKYIJVSFVBOV-UHFFFAOYSA-N
XLogP30.48
TPSA566.40 Ų
H-Bond Donors13
H-Bond Acceptors51
Rotatable Bonds29
Heavy Atoms309
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004390.93
LogP ≤ 530.48
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1051

Analyze 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane?
The IUPAC name of 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane (CID 161370312) is 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane.
What is the SMILES notation for 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane?
The canonical SMILES for 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane is C.C.C.C.C.C.C.C.C.C.C.C.C=C(CO)N1CCC2(CCN(C(C)C)C2)C1.CC(C)(C)N1CCC2(CCCN(C(=O)CO)C2)C1.CC(C)(C)N1CCC2(CCN(C(=O)CO)CC2)C1.CC(C)C1CCC2(CCCCN2C(=O)CO)C1.CC(C)C1NCCC12CCN(C(=O)CO)CC2.CC(C)N1C(=O)CN2CCC1CC2.CC(C)N1C2CCC1CNC2.CC(C)N1C2CNCC1C2.CC(C)N1CC2CC1CN2.CC(C)N1CC2CC1CO2.CC(C)N1CC2CC1CS2.CC(C)N1CC2CCC(C1)O2.CC(C)N1CC2CCC(C2)C1.CC(C)N1CCC2(CC1)CC(=O)N(C(=O)CO)C2.CC(C)N1CCC2(CCCN2C(=O)CO)C1.CC(C)N1CCC2(CCN(C(=O)CO)C2)CC1=O.CC(C)N1CCCC2(CCN(C(=O)CO)C2)C1.CC12CC1CN(C(C)(C)C)C2.CN(C)C12CC1CN(C(C)(C)C)C2.CN(C)C1C2CN(C(C)(C)C)CC21.COC(=O)CN1CCC2(CCCCN2C(C)(C)C)C1.
What is the InChIKey of 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane?
The InChIKey is VQJKYIJVSFVBOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2.2C14H26N2O2.C14H25NO2.2C13H22N2O3.2C13H24N2O2.C13H24N2O.C12H22N2O2.2C11H22N2.C10H18N2O.2C10H19N.C9H18N2.C9H17NO.2C8H16N2.C8H15NO.C8H15NS.12CH4/c1-14(2,3)17-9-6-5-7-15(17)8-10-16(12-15)11-13(18)19-4;1-13(2,3)16-9-6-14(11-16)4-7-15(8-5-14)12(18)10-17;1-13(2,3)16-8-6-14(11-16)5-4-7-15(10-14)12(18)9-17;1-11(2)12-5-7-14(9-12)6-3-4-8-15(14)13(17)10-16;1-10(2)15-6-4-13(7-11(15)17)3-5-14(9-13)12(18)8-16;1-10(2)14-5-3-13(4-6-14)7-11(17)15(9-13)12(18)8-16;1-10(2)12-13(3-6-14-12)4-7-15(8-5-13)11(17)9-16;1-11(2)14-6-3-4-13(9-14)5-7-15(10-13)12(17)8-16;1-11(2)14-6-4-13(9-14)5-7-15(10-13)12(3)8-16;1-10(2)13-7-5-12(9-13)4-3-6-14(12)11(16)8-15;1-10(2,3)13-7-9-6-11(9,8-13)12(4)5;1-11(2,3)13-6-8-9(7-13)10(8)12(4)5;1-8(2)12-9-3-5-11(6-4-9)7-10(12)13;1-9(2,3)11-6-8-5-10(8,4)7-11;1-8(2)11-6-9-3-4-10(5-9)7-11;1-7(2)11-8-3-4-9(11)6-10-5-8;1-7(2)10-5-8-3-4-9(6-10)11-8;1-6(2)10-5-7-3-8(10)4-9-7;1-6(2)10-7-3-8(10)5-9-4-7;2*1-6(2)9-4-8-3-7(9)5-10-8;;;;;;;;;;;;/h5-12H2,1-4H3;2*17H,4-11H2,1-3H3;11-12,16H,3-10H2,1-2H3;2*10,16H,3-9H2,1-2H3;10,12,14,16H,3-9H2,1-2H3;11,16H,3-10H2,1-2H3;11,16H,3-10H2,1-2H3;10,15H,3-9H2,1-2H3;9H,6-8H2,1-5H3;8-10H,6-7H2,1-5H3;8-9H,3-7H2,1-2H3;8H,5-7H2,1-4H3;8-10H,3-7H2,1-2H3;7-10H,3-6H2,1-2H3;7-9H,3-6H2,1-2H3;2*6-9H,3-5H2,1-2H3;2*6-8H,3-5H2,1-2H3;12*1H4.
What are the key properties of 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane?
1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane has a molecular weight of 4390.93 g/mol, XLogP of 30.48, 29 rotatable bonds, 13 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-tert-butyl-2,8-diazaspiro[4.5]decan-8-yl)-2-hydroxyethanone;1-(2-tert-butyl-2,9-diazaspiro[4.5]decan-9-yl)-2-hydroxyethanone;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-1-amine;3-tert-butyl-N,N-dimethyl-3-azabicyclo[3.1.0]hexan-6-amine;3-tert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-3-one;2-(2-hydroxyacetyl)-8-propan-2-yl-2,8-diazaspiro[4.5]decan-7-one;2-hydroxy-1-(3-propan-2-yl-6-azaspiro[4.5]decan-6-yl)ethanone;2-hydroxy-1-(1-propan-2-yl-2,8-diazaspiro[4.5]decan-8-yl)ethanone;2-hydroxy-1-(9-propan-2-yl-2,9-diazaspiro[4.5]decan-2-yl)ethanone;2-hydroxy-1-(7-propan-2-yl-1,7-diazaspiro[4.4]nonan-1-yl)ethanone;methane;methyl 2-(6-tert-butyl-2,6-diazaspiro[4.5]decan-2-yl)acetate;3-propan-2-yl-3-azabicyclo[3.2.1]octane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;6-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;4-propan-2-yl-1,4-diazabicyclo[3.2.2]nonan-3-one;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;2-(7-propan-2-yl-2,7-diazaspiro[4.4]nonan-2-yl)prop-2-en-1-ol;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-thia-5-azabicyclo[2.2.1]heptane is sourced from PubChem (CID 161370312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).