8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane

C181H332F18N20O9 — CID 159630772

IUPAC8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane
SMILESCC(C)(C)N1C2CCC1CC(F)(F)C2.CC(C)(C)N1C2CCC1COC2.CC(C)(C)N1C2CCCC1CC2.CC(C)(C)N1CC(F)C2(CC2)C1.CC(C)(C)N1CC2C(C1)C2(F)F.CC(C)(C)N1CCC1(F)F.CC(C)(C)N1CCC2(CC2)C1.CC(C)N1C2CCC(OC2)C1C(F)(F)F.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)N1CCC12CC(F)(F)C2.CC(C)N1CCCC1C.CC(C)N1CCOC2(CC2)C1.CC(C)N1CCOC2(CCC2)C1.CC(C)N1CCOC2CC21.CC(C)N1CCOCC12CC2.CC1CCN1C(C)(C)C
InChIInChI=1S/C11H19F2N.C11H21N.C10H16F3NO.C10H18FN.2C10H19NO.C10H19N.C9H14F3N.2C9H15F2N.4C9H17NO.2C8H15NO.2C8H17N.C7H12F3N.C7H13F2N/c1-10(2,3)14-8-4-5-9(14)7-11(12,13)6-8;1-11(2,3)12-9-5-4-6-10(12)8-7-9;1-6(2)14-7-3-4-8(15-5-7)9(14)10(11,12)13;1-9(2,3)12-6-8(11)10(7-12)4-5-10;1-10(2,3)11-8-4-5-9(11)7-12-6-8;1-9(2)11-6-7-12-10(8-11)4-3-5-10;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;1-8(2,3)12-4-6-7(5-12)9(6,10)11;1-7(2)12-4-3-8(12)5-9(10,11)6-8;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;1-6(2)9-4-8-3-7(9)5-10-8;1-6(2)9-3-4-10-8-5-7(8)9;1-7-5-6-9(7)8(2,3)4;1-7(2)9-6-4-5-8(9)3;1-5(2)11-3-6(4-11)7(8,9)10;1-6(2,3)10-5-4-7(10,8)9/h8-9H,4-7H2,1-3H3;9-10H,4-8H2,1-3H3;6-9H,3-5H2,1-2H3;8H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;9H,3-8H2,1-2H3;4-8H2,1-3H3;5-8H,3-4H2,1-2H3;6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;2*7-9H,3-6H2,1-2H3;2*8H,3-7H2,1-2H3;2*6-8H,3-5H2,1-2H3;7H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;5-6H,3-4H2,1-2H3;4-5H2,1-3H3
InChIKeyMPCCVVUTAGPMLF-UHFFFAOYSA-N
MW3274.74 g/mol
LogP36.85
Rot. Bonds12

About 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane

8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane (PubChem CID 159630772) has the molecular formula C181H332F18N20O9 and a molecular weight of 3274.74 g/mol. Its IUPAC name is 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane.

Molecular Properties

Compound Name8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane
PubChem CID159630772
Molecular FormulaC181H332F18N20O9
Molecular Weight3274.74 g/mol
Exact Mass3272.58
IUPAC Name8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane
SMILESCC(C)(C)N1C2CCC1CC(F)(F)C2.CC(C)(C)N1C2CCC1COC2.CC(C)(C)N1C2CCCC1CC2.CC(C)(C)N1CC(F)C2(CC2)C1.CC(C)(C)N1CC2C(C1)C2(F)F.CC(C)(C)N1CCC1(F)F.CC(C)(C)N1CCC2(CC2)C1.CC(C)N1C2CCC(OC2)C1C(F)(F)F.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)N1CCC12CC(F)(F)C2.CC(C)N1CCCC1C.CC(C)N1CCOC2(CC2)C1.CC(C)N1CCOC2(CCC2)C1.CC(C)N1CCOC2CC21.CC(C)N1CCOCC12CC2.CC1CCN1C(C)(C)C
InChIInChI=1S/C11H19F2N.C11H21N.C10H16F3NO.C10H18FN.2C10H19NO.C10H19N.C9H14F3N.2C9H15F2N.4C9H17NO.2C8H15NO.2C8H17N.C7H12F3N.C7H13F2N/c1-10(2,3)14-8-4-5-9(14)7-11(12,13)6-8;1-11(2,3)12-9-5-4-6-10(12)8-7-9;1-6(2)14-7-3-4-8(15-5-7)9(14)10(11,12)13;1-9(2,3)12-6-8(11)10(7-12)4-5-10;1-10(2,3)11-8-4-5-9(11)7-12-6-8;1-9(2)11-6-7-12-10(8-11)4-3-5-10;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;1-8(2,3)12-4-6-7(5-12)9(6,10)11;1-7(2)12-4-3-8(12)5-9(10,11)6-8;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;1-6(2)9-4-8-3-7(9)5-10-8;1-6(2)9-3-4-10-8-5-7(8)9;1-7-5-6-9(7)8(2,3)4;1-7(2)9-6-4-5-8(9)3;1-5(2)11-3-6(4-11)7(8,9)10;1-6(2,3)10-5-4-7(10,8)9/h8-9H,4-7H2,1-3H3;9-10H,4-8H2,1-3H3;6-9H,3-5H2,1-2H3;8H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;9H,3-8H2,1-2H3;4-8H2,1-3H3;5-8H,3-4H2,1-2H3;6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;2*7-9H,3-6H2,1-2H3;2*8H,3-7H2,1-2H3;2*6-8H,3-5H2,1-2H3;7H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;5-6H,3-4H2,1-2H3;4-5H2,1-3H3
InChIKeyMPCCVVUTAGPMLF-UHFFFAOYSA-N
XLogP36.85
TPSA147.87 Ų
H-Bond Donors
H-Bond Acceptors29
Rotatable Bonds12
Heavy Atoms228
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003274.74
LogP ≤ 536.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane with MolForge

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Related Compounds

CID 158350626
CID 158350626
CID 158693817
CID 158693817
6,6-Difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-difluoro-8-propan-2-yl-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2,2-difluoro-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylpiperidine;7-fluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;2-methyl-1-propan-2-ylazetidine;2-methyl-1-propan-2-ylpyrrolidine;5-propan-2-yl-5-azaspiro[2.4]heptane;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane
CID 159670179
6,6-Difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-difluoro-8-propan-2-yl-8-azabicyclo[3.2.1]octane;2,2-difluoro-1-propan-2-ylazetidine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;7-fluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;2-methyl-1-propan-2-ylazetidine;5-propan-2-yl-5-azaspiro[2.4]heptane;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane
CID 161855438
CID 161971603
CID 161971603
6,6-Difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-difluoro-8-propan-2-yl-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2,2-difluoro-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylpiperidine;2,4-dimethyl-1-propan-2-ylpiperazine;7-fluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;methane;2-methyl-1-propan-2-ylazetidine;6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;2-methyl-1-propan-2-ylpyrrolidine;5-propan-2-yl-5-azaspiro[2.4]heptane;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine
CID 164986567
5-Tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;1-tert-butyl-2,2-difluoroazetidine;8-tert-butyl-3,3-difluorobicyclo[3.2.1]octane;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;3-tert-butyl-8-oxa-3-azabicyclo[3.2.1]octane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;3,3-difluoro-1-propan-2-ylpiperidine;2,4-dimethyl-1-propan-2-ylpiperazine;2-methyl-1-propan-2-ylpiperidine;2-methyl-1-propan-2-ylpyrrolidine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.1]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[4.1.0]heptane;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane;1-propan-2-yl-2-(trifluoromethyl)piperidine
CID 165017233
5-Tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;5-tert-butyl-7-methyl-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;2,2-difluoro-1-methylazetidine;6-fluoro-6-methyl-1-propan-2-yl-1-azaspiro[3.3]heptane;methane;2-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane
CID 165026515
8-Tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-7-methyl-5-azaspiro[2.4]heptane;5-tert-butyl-2-oxa-5-azabicyclo[4.1.0]heptane;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;8-tert-butyl-5-oxa-8-azaspiro[3.5]nonane;4-tert-butyl-7-oxa-4-azaspiro[2.5]octane;7-tert-butyl-4-oxa-7-azaspiro[2.5]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;methane;6-methyl-5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;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-oxa-5-azabicyclo[2.2.2]octane
CID 165037594
CID 165064318
CID 165064318
(1R,4S)-2-propan-2-yl-2-azabicyclo[2.2.1]heptane;(1R,5S)-3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.1]heptane;3-propan-2-yl-3-azabicyclo[4.1.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2-propan-2-yl-2-azabicyclo[2.2.2]octane;3-propan-2-yl-3-azabicyclo[3.2.1]octane;8-propan-2-yl-8-azabicyclo[3.2.1]octane;2-propan-2-yl-2-azaspiro[3.3]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;1-propan-2-ylazepane;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;bis(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-3-oxa-8-azabicyclo[3.2.1]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;2-propan-2-yl-5-oxa-2-azatricyclo[5.1.0.01,3]octane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 158007814
(1R,4S)-2-propan-2-yl-2-azabicyclo[2.2.1]heptane;(1R,5S)-3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.1]heptane;3-propan-2-yl-3-azabicyclo[4.1.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-propan-2-yl-3-azabicyclo[3.2.1]octane;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;5-propan-2-yl-5-azaspiro[2.5]octane;1-propan-2-ylazepane;1-propan-2-ylazetidine;4-propan-2-ylmorpholine;bis(3-propan-2-yl-8-oxa-3-azabicyclo[3.2.1]octane);5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane;2-propan-2-yl-5-oxa-2-azatricyclo[5.1.0.01,3]octane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 158372980

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;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane?
The IUPAC name of 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane (CID 159630772) is 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane.
What is the SMILES notation for 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane?
The canonical SMILES for 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane is CC(C)(C)N1C2CCC1CC(F)(F)C2.CC(C)(C)N1C2CCC1COC2.CC(C)(C)N1C2CCCC1CC2.CC(C)(C)N1CC(F)C2(CC2)C1.CC(C)(C)N1CC2C(C1)C2(F)F.CC(C)(C)N1CCC1(F)F.CC(C)(C)N1CCC2(CC2)C1.CC(C)N1C2CCC(OC2)C1C(F)(F)F.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)N1CCC12CC(F)(F)C2.CC(C)N1CCCC1C.CC(C)N1CCOC2(CC2)C1.CC(C)N1CCOC2(CCC2)C1.CC(C)N1CCOC2CC21.CC(C)N1CCOCC12CC2.CC1CCN1C(C)(C)C.
What is the InChIKey of 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane?
The InChIKey is MPCCVVUTAGPMLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F2N.C11H21N.C10H16F3NO.C10H18FN.2C10H19NO.C10H19N.C9H14F3N.2C9H15F2N.4C9H17NO.2C8H15NO.2C8H17N.C7H12F3N.C7H13F2N/c1-10(2,3)14-8-4-5-9(14)7-11(12,13)6-8;1-11(2,3)12-9-5-4-6-10(12)8-7-9;1-6(2)14-7-3-4-8(15-5-7)9(14)10(11,12)13;1-9(2,3)12-6-8(11)10(7-12)4-5-10;1-10(2,3)11-8-4-5-9(11)7-12-6-8;1-9(2)11-6-7-12-10(8-11)4-3-5-10;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;1-8(2,3)12-4-6-7(5-12)9(6,10)11;1-7(2)12-4-3-8(12)5-9(10,11)6-8;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;1-6(2)9-4-8-3-7(9)5-10-8;1-6(2)9-3-4-10-8-5-7(8)9;1-7-5-6-9(7)8(2,3)4;1-7(2)9-6-4-5-8(9)3;1-5(2)11-3-6(4-11)7(8,9)10;1-6(2,3)10-5-4-7(10,8)9/h8-9H,4-7H2,1-3H3;9-10H,4-8H2,1-3H3;6-9H,3-5H2,1-2H3;8H,4-7H2,1-3H3;8-9H,4-7H2,1-3H3;9H,3-8H2,1-2H3;4-8H2,1-3H3;5-8H,3-4H2,1-2H3;6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;2*7-9H,3-6H2,1-2H3;2*8H,3-7H2,1-2H3;2*6-8H,3-5H2,1-2H3;7H,5-6H2,1-4H3;7-8H,4-6H2,1-3H3;5-6H,3-4H2,1-2H3;4-5H2,1-3H3.
What are the key properties of 8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane?
8-tert-butyl-8-azabicyclo[3.2.1]octane;5-tert-butyl-5-azaspiro[2.4]heptane;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane has a molecular weight of 3274.74 g/mol, XLogP of 36.85, 12 rotatable bonds, 0 hydrogen bond donors, and 29 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;3-tert-butyl-6,6-difluoro-3-azabicyclo[3.1.0]hexane;8-tert-butyl-3,3-difluoro-8-azabicyclo[3.2.1]octane;1-tert-butyl-2,2-difluoroazetidine;5-tert-butyl-7-fluoro-5-azaspiro[2.4]heptane;1-tert-butyl-2-methylazetidine;8-tert-butyl-3-oxa-8-azabicyclo[3.2.1]octane;6,6-difluoro-1-propan-2-yl-1-azaspiro[3.3]heptane;2-methyl-1-propan-2-ylpyrrolidine;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;3-propan-2-yl-2-(trifluoromethyl)-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;5-propan-2-yl-6-(trifluoromethyl)-2-oxa-5-azabicyclo[2.2.2]octane is sourced from PubChem (CID 159630772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).