8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine

C236H456F17N27O20S2 — CID 165064318

IUPAC8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine
SMILESCC(C)(C)N1C2CCC1COC2.CC(C)(C)N1C2CCCC1CC2.CC(C)(C)N1CCC2(CC2)C1.CC(C)C1COCCN1C(C)C.CC(C)N1C2CCC(OC2)C1C.CC(C)N1CC(C(F)(F)F)C1.CC(C)N1CC2CC1CO2.CC(C)N1CC2CC2C1C(F)(F)F.CC(C)N1CC2CCC(C1)O2.CC(C)N1CC2CCC1CO2.CC(C)N1CCC(C)(O)CC1.CC(C)N1CCC(F)(F)CC1.CC(C)N1CCC12CC(C)(F)C2.CC(C)N1CCCC(F)(F)C1.CC(C)N1CCCCC1C(F)(F)F.CC(C)N1CCOC(C)(C)C1.CC(C)N1CCOC2(CC2)C1.CC(C)N1CCOC2(CCC2)C1.CC(C)N1CCOC2CC21.CC(C)N1CCOCC1.CC(C)N1CCOCC12CC2.CC(C)N1CCOCC1C(F)(F)F.CC(C)N1CCS(=O)(=O)C(C)C1.CC(C)N1CCS(=O)(=O)CC1.CC1CCN1C(C)(C)C.CC1CN(C(C)C)CCO1.CC1CN(C(C)C)CCO1
InChIInChI=1S/C11H21N.C10H18FN.3C10H19NO.C10H21NO.C10H19N.C9H14F3N.C9H16F3N.4C9H17NO.2C9H19NO.C8H14F3NO.2C8H15F2N.C8H17NO2S.2C8H15NO.2C8H17NO.C8H17N.C7H12F3N.C7H15NO2S.C7H15NO/c1-11(2,3)12-9-5-4-6-10(12)8-7-9;1-8(2)12-5-4-10(12)6-9(3,11)7-10;1-10(2,3)11-8-4-5-9(11)7-12-6-8;1-7(2)11-8(3)10-5-4-9(11)6-12-10;1-9(2)11-6-7-12-10(8-11)4-3-5-10;1-8(2)10-7-12-6-5-11(10)9(3)4;1-9(2,3)11-7-6-10(8-11)4-5-10;1-5(2)13-4-6-3-7(6)8(13)9(10,11)12;1-7(2)13-6-4-3-5-8(13)9(10,11)12;1-7(2)10-5-9-4-3-8(10)6-11-9;1-7(2)10-5-8-3-4-9(6-10)11-8;1-8(2)10-5-6-11-7-9(10)3-4-9;1-8(2)10-5-6-11-9(7-10)3-4-9;1-8(2)10-5-6-11-9(3,4)7-10;1-8(2)10-6-4-9(3,11)5-7-10;1-6(2)12-3-4-13-5-7(12)8(9,10)11;1-7(2)11-5-3-8(9,10)4-6-11;1-7(2)11-5-3-4-8(9,10)6-11;1-7(2)9-4-5-12(10,11)8(3)6-9;1-6(2)9-4-8-3-7(9)5-10-8;1-6(2)9-3-4-10-8-5-7(8)9;2*1-7(2)9-4-5-10-8(3)6-9;1-7-5-6-9(7)8(2,3)4;1-5(2)11-3-6(4-11)7(8,9)10;1-7(2)8-3-5-11(9,10)6-4-8;1-7(2)8-3-5-9-6-4-8/h9-10H,4-8H2,1-3H3;8H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;7-10H,4-6H2,1-3H3;9H,3-8H2,1-2H3;8-10H,5-7H2,1-4H3;4-8H2,1-3H3;5-8H,3-4H2,1-2H3;7-8H,3-6H2,1-2H3;2*7-9H,3-6H2,1-2H3;2*8H,3-7H2,1-2H3;8H,5-7H2,1-4H3;8,11H,4-7H2,1-3H3;6-7H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;7-8H,4-6H2,1-3H3;2*6-8H,3-5H2,1-2H3;2*7-8H,4-6H2,1-3H3;7H,5-6H2,1-4H3;5-6H,3-4H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3
InChIKeyRSIMSUAZDSLPRA-UHFFFAOYSA-N
MW4379.51 g/mol
LogP42.01
Rot. Bonds24

About 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine

8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine (PubChem CID 165064318) has the molecular formula C236H456F17N27O20S2 and a molecular weight of 4379.51 g/mol. Its IUPAC name is 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine.

Molecular Properties

Compound Name8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine
PubChem CID165064318
Molecular FormulaC236H456F17N27O20S2
Molecular Weight4379.51 g/mol
Exact Mass4376.47
IUPAC Name8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine
SMILESCC(C)(C)N1C2CCC1COC2.CC(C)(C)N1C2CCCC1CC2.CC(C)(C)N1CCC2(CC2)C1.CC(C)C1COCCN1C(C)C.CC(C)N1C2CCC(OC2)C1C.CC(C)N1CC(C(F)(F)F)C1.CC(C)N1CC2CC1CO2.CC(C)N1CC2CC2C1C(F)(F)F.CC(C)N1CC2CCC(C1)O2.CC(C)N1CC2CCC1CO2.CC(C)N1CCC(C)(O)CC1.CC(C)N1CCC(F)(F)CC1.CC(C)N1CCC12CC(C)(F)C2.CC(C)N1CCCC(F)(F)C1.CC(C)N1CCCCC1C(F)(F)F.CC(C)N1CCOC(C)(C)C1.CC(C)N1CCOC2(CC2)C1.CC(C)N1CCOC2(CCC2)C1.CC(C)N1CCOC2CC21.CC(C)N1CCOCC1.CC(C)N1CCOCC12CC2.CC(C)N1CCOCC1C(F)(F)F.CC(C)N1CCS(=O)(=O)C(C)C1.CC(C)N1CCS(=O)(=O)CC1.CC1CCN1C(C)(C)C.CC1CN(C(C)C)CCO1.CC1CN(C(C)C)CCO1
InChIInChI=1S/C11H21N.C10H18FN.3C10H19NO.C10H21NO.C10H19N.C9H14F3N.C9H16F3N.4C9H17NO.2C9H19NO.C8H14F3NO.2C8H15F2N.C8H17NO2S.2C8H15NO.2C8H17NO.C8H17N.C7H12F3N.C7H15NO2S.C7H15NO/c1-11(2,3)12-9-5-4-6-10(12)8-7-9;1-8(2)12-5-4-10(12)6-9(3,11)7-10;1-10(2,3)11-8-4-5-9(11)7-12-6-8;1-7(2)11-8(3)10-5-4-9(11)6-12-10;1-9(2)11-6-7-12-10(8-11)4-3-5-10;1-8(2)10-7-12-6-5-11(10)9(3)4;1-9(2,3)11-7-6-10(8-11)4-5-10;1-5(2)13-4-6-3-7(6)8(13)9(10,11)12;1-7(2)13-6-4-3-5-8(13)9(10,11)12;1-7(2)10-5-9-4-3-8(10)6-11-9;1-7(2)10-5-8-3-4-9(6-10)11-8;1-8(2)10-5-6-11-7-9(10)3-4-9;1-8(2)10-5-6-11-9(7-10)3-4-9;1-8(2)10-5-6-11-9(3,4)7-10;1-8(2)10-6-4-9(3,11)5-7-10;1-6(2)12-3-4-13-5-7(12)8(9,10)11;1-7(2)11-5-3-8(9,10)4-6-11;1-7(2)11-5-3-4-8(9,10)6-11;1-7(2)9-4-5-12(10,11)8(3)6-9;1-6(2)9-4-8-3-7(9)5-10-8;1-6(2)9-3-4-10-8-5-7(8)9;2*1-7(2)9-4-5-10-8(3)6-9;1-7-5-6-9(7)8(2,3)4;1-5(2)11-3-6(4-11)7(8,9)10;1-7(2)8-3-5-11(9,10)6-4-8;1-7(2)8-3-5-9-6-4-8/h9-10H,4-8H2,1-3H3;8H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;7-10H,4-6H2,1-3H3;9H,3-8H2,1-2H3;8-10H,5-7H2,1-4H3;4-8H2,1-3H3;5-8H,3-4H2,1-2H3;7-8H,3-6H2,1-2H3;2*7-9H,3-6H2,1-2H3;2*8H,3-7H2,1-2H3;8H,5-7H2,1-4H3;8,11H,4-7H2,1-3H3;6-7H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;7-8H,4-6H2,1-3H3;2*6-8H,3-5H2,1-2H3;2*7-8H,4-6H2,1-3H3;7H,5-6H2,1-4H3;5-6H,3-4H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3
InChIKeyRSIMSUAZDSLPRA-UHFFFAOYSA-N
XLogP42.01
TPSA314.44 Ų
H-Bond Donors1
H-Bond Acceptors47
Rotatable Bonds24
Heavy Atoms302
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004379.51
LogP ≤ 542.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1047

Analyze 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine?
The IUPAC name of 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine (CID 165064318) is 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine.
What is the SMILES notation for 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine?
The canonical SMILES for 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine is CC(C)(C)N1C2CCC1COC2.CC(C)(C)N1C2CCCC1CC2.CC(C)(C)N1CCC2(CC2)C1.CC(C)C1COCCN1C(C)C.CC(C)N1C2CCC(OC2)C1C.CC(C)N1CC(C(F)(F)F)C1.CC(C)N1CC2CC1CO2.CC(C)N1CC2CC2C1C(F)(F)F.CC(C)N1CC2CCC(C1)O2.CC(C)N1CC2CCC1CO2.CC(C)N1CCC(C)(O)CC1.CC(C)N1CCC(F)(F)CC1.CC(C)N1CCC12CC(C)(F)C2.CC(C)N1CCCC(F)(F)C1.CC(C)N1CCCCC1C(F)(F)F.CC(C)N1CCOC(C)(C)C1.CC(C)N1CCOC2(CC2)C1.CC(C)N1CCOC2(CCC2)C1.CC(C)N1CCOC2CC21.CC(C)N1CCOCC1.CC(C)N1CCOCC12CC2.CC(C)N1CCOCC1C(F)(F)F.CC(C)N1CCS(=O)(=O)C(C)C1.CC(C)N1CCS(=O)(=O)CC1.CC1CCN1C(C)(C)C.CC1CN(C(C)C)CCO1.CC1CN(C(C)C)CCO1.
What is the InChIKey of 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine?
The InChIKey is RSIMSUAZDSLPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N.C10H18FN.3C10H19NO.C10H21NO.C10H19N.C9H14F3N.C9H16F3N.4C9H17NO.2C9H19NO.C8H14F3NO.2C8H15F2N.C8H17NO2S.2C8H15NO.2C8H17NO.C8H17N.C7H12F3N.C7H15NO2S.C7H15NO/c1-11(2,3)12-9-5-4-6-10(12)8-7-9;1-8(2)12-5-4-10(12)6-9(3,11)7-10;1-10(2,3)11-8-4-5-9(11)7-12-6-8;1-7(2)11-8(3)10-5-4-9(11)6-12-10;1-9(2)11-6-7-12-10(8-11)4-3-5-10;1-8(2)10-7-12-6-5-11(10)9(3)4;1-9(2,3)11-7-6-10(8-11)4-5-10;1-5(2)13-4-6-3-7(6)8(13)9(10,11)12;1-7(2)13-6-4-3-5-8(13)9(10,11)12;1-7(2)10-5-9-4-3-8(10)6-11-9;1-7(2)10-5-8-3-4-9(6-10)11-8;1-8(2)10-5-6-11-7-9(10)3-4-9;1-8(2)10-5-6-11-9(7-10)3-4-9;1-8(2)10-5-6-11-9(3,4)7-10;1-8(2)10-6-4-9(3,11)5-7-10;1-6(2)12-3-4-13-5-7(12)8(9,10)11;1-7(2)11-5-3-8(9,10)4-6-11;1-7(2)11-5-3-4-8(9,10)6-11;1-7(2)9-4-5-12(10,11)8(3)6-9;1-6(2)9-4-8-3-7(9)5-10-8;1-6(2)9-3-4-10-8-5-7(8)9;2*1-7(2)9-4-5-10-8(3)6-9;1-7-5-6-9(7)8(2,3)4;1-5(2)11-3-6(4-11)7(8,9)10;1-7(2)8-3-5-11(9,10)6-4-8;1-7(2)8-3-5-9-6-4-8/h9-10H,4-8H2,1-3H3;8H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;7-10H,4-6H2,1-3H3;9H,3-8H2,1-2H3;8-10H,5-7H2,1-4H3;4-8H2,1-3H3;5-8H,3-4H2,1-2H3;7-8H,3-6H2,1-2H3;2*7-9H,3-6H2,1-2H3;2*8H,3-7H2,1-2H3;8H,5-7H2,1-4H3;8,11H,4-7H2,1-3H3;6-7H,3-5H2,1-2H3;2*7H,3-6H2,1-2H3;7-8H,4-6H2,1-3H3;2*6-8H,3-5H2,1-2H3;2*7-8H,4-6H2,1-3H3;7H,5-6H2,1-4H3;5-6H,3-4H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3.
What are the key properties of 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine?
8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine has a molecular weight of 4379.51 g/mol, XLogP of 42.01, 24 rotatable bonds, 1 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-4-propan-2-ylmorpholine;3,4-di(propan-2-yl)morpholine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;bis(2-methyl-4-propan-2-ylmorpholine);6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;4-methyl-1-propan-2-ylpiperidin-4-ol;2-methyl-4-propan-2-yl-1,4-thiazinane 1,1-dioxide;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;8-propan-2-yl-5-oxa-8-azaspiro[3.5]nonane;4-propan-2-yl-7-oxa-4-azaspiro[2.5]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;4-propan-2-yl-1,4-thiazinane 1,1-dioxide;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;4-propan-2-yl-3-(trifluoromethyl)morpholine;1-propan-2-yl-2-(trifluoromethyl)piperidine is sourced from PubChem (CID 165064318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).