6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane

C222H427F4N25O8 — CID 158350626

IUPAC6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane
SMILESCC(C)N1C2CCCC1CC2.CC(C)N1C2CCCC1CC2.CC(C)N1C2COCC1C2.CC(C)N1CC(C)(C)C1.CC(C)N1CC(C)(CO)C1.CC(C)N1CC(C)(O)C1.CC(C)N1CC2(CCC2)C1.CC(C)N1CC2C(C1)C2(C)C.CC(C)N1CC2C(C1)C2(F)F.CC(C)N1CC2CC(C2)C1.CC(C)N1CC2CC2(C)C1.CC(C)N1CC2CC2C1.CC(C)N1CC2CCC(C1)O2.CC(C)N1CC2CCC(C2)C1.CC(C)N1CC2CCC1CC2.CC(C)N1CC2CCC1CO2.CC(C)N1CCC2(C1)CC2(F)F.CC(C)N1CCC2CC2C1.CC(C)N1CCCC2(CCC2)C1.CC(C)N1CCCCCC1.CC(C)N1CCOC2(CC2)C1.CC(C)N1CCOCC1.CC(C)N1C[C@H]2CC[C@@H]1C2.CC(C)N1C[C@H]2CC[C@H]2C1.COC1(C)CN(C(C)C)C1
InChIInChI=1S/C11H21N.5C10H19N.C9H15F2N.3C9H17NO.6C9H17N.C9H19N.C8H13F2N.C8H15NO.2C8H17NO.C8H15N.C8H17N.2C7H15NO/c1-10(2)12-8-4-7-11(9-12)5-3-6-11;1-7(2)11-5-8-9(6-11)10(8,3)4;1-8(2)11-7-9-3-5-10(11)6-4-9;1-8(2)11-6-9-3-4-10(5-9)7-11;2*1-8(2)11-9-4-3-5-10(11)7-6-9;1-7(2)12-4-3-8(6-12)5-9(8,10)11;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)10-5-6-11-9(7-10)3-4-9;1-7(2)10-5-8-4-9(8,3)6-10;1-7(2)10-5-8-3-9(4-8)6-10;1-7(2)10-4-3-8-5-9(8)6-10;1-7(2)10-5-8-3-4-9(8)6-10;1-7(2)10-6-8-3-4-9(10)5-8;1-8(2)10-6-9(7-10)4-3-5-9;1-9(2)10-7-5-3-4-6-8-10;1-5(2)11-3-6-7(4-11)8(6,9)10;1-6(2)9-7-3-8(9)5-10-4-7;1-7(2)9-5-8(3,6-9)10-4;1-7(2)9-4-8(3,5-9)6-10;1-6(2)9-4-7-3-8(7)5-9;1-7(2)9-5-8(3,4)6-9;1-6(2)8-4-7(3,9)5-8;1-7(2)8-3-5-9-6-4-8/h10H,3-9H2,1-2H3;7-9H,5-6H2,1-4H3;4*8-10H,3-7H2,1-2H3;7H,3-6H2,1-2H3;2*7-9H,3-6H2,1-2H3;8H,3-7H2,1-2H3;7-8H,4-6H2,1-3H3;4*7-9H,3-6H2,1-2H3;8H,3-7H2,1-2H3;9H,3-8H2,1-2H3;5-7H,3-4H2,1-2H3;6-8H,3-5H2,1-2H3;7H,5-6H2,1-4H3;7,10H,4-6H2,1-3H3;6-8H,3-5H2,1-2H3;7H,5-6H2,1-4H3;6,9H,4-5H2,1-3H3;7H,3-6H2,1-2H3/t;;;;;;;;;;;;;2*8-,9+;;;;;;;;;;/m..............0........../s1
InChIKeyGSGPSZCVEGIMSQ-ACCVSHHESA-N
MW3651.02 g/mol
LogP41.30
Rot. Bonds27

About 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane

6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane (PubChem CID 158350626) has the molecular formula C222H427F4N25O8 and a molecular weight of 3651.02 g/mol. Its IUPAC name is 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane.

Molecular Properties

Compound Name6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane
PubChem CID158350626
Molecular FormulaC222H427F4N25O8
Molecular Weight3651.02 g/mol
Exact Mass3648.37
IUPAC Name6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane
SMILESCC(C)N1C2CCCC1CC2.CC(C)N1C2CCCC1CC2.CC(C)N1C2COCC1C2.CC(C)N1CC(C)(C)C1.CC(C)N1CC(C)(CO)C1.CC(C)N1CC(C)(O)C1.CC(C)N1CC2(CCC2)C1.CC(C)N1CC2C(C1)C2(C)C.CC(C)N1CC2C(C1)C2(F)F.CC(C)N1CC2CC(C2)C1.CC(C)N1CC2CC2(C)C1.CC(C)N1CC2CC2C1.CC(C)N1CC2CCC(C1)O2.CC(C)N1CC2CCC(C2)C1.CC(C)N1CC2CCC1CC2.CC(C)N1CC2CCC1CO2.CC(C)N1CCC2(C1)CC2(F)F.CC(C)N1CCC2CC2C1.CC(C)N1CCCC2(CCC2)C1.CC(C)N1CCCCCC1.CC(C)N1CCOC2(CC2)C1.CC(C)N1CCOCC1.CC(C)N1C[C@H]2CC[C@@H]1C2.CC(C)N1C[C@H]2CC[C@H]2C1.COC1(C)CN(C(C)C)C1
InChIInChI=1S/C11H21N.5C10H19N.C9H15F2N.3C9H17NO.6C9H17N.C9H19N.C8H13F2N.C8H15NO.2C8H17NO.C8H15N.C8H17N.2C7H15NO/c1-10(2)12-8-4-7-11(9-12)5-3-6-11;1-7(2)11-5-8-9(6-11)10(8,3)4;1-8(2)11-7-9-3-5-10(11)6-4-9;1-8(2)11-6-9-3-4-10(5-9)7-11;2*1-8(2)11-9-4-3-5-10(11)7-6-9;1-7(2)12-4-3-8(6-12)5-9(8,10)11;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)10-5-6-11-9(7-10)3-4-9;1-7(2)10-5-8-4-9(8,3)6-10;1-7(2)10-5-8-3-9(4-8)6-10;1-7(2)10-4-3-8-5-9(8)6-10;1-7(2)10-5-8-3-4-9(8)6-10;1-7(2)10-6-8-3-4-9(10)5-8;1-8(2)10-6-9(7-10)4-3-5-9;1-9(2)10-7-5-3-4-6-8-10;1-5(2)11-3-6-7(4-11)8(6,9)10;1-6(2)9-7-3-8(9)5-10-4-7;1-7(2)9-5-8(3,6-9)10-4;1-7(2)9-4-8(3,5-9)6-10;1-6(2)9-4-7-3-8(7)5-9;1-7(2)9-5-8(3,4)6-9;1-6(2)8-4-7(3,9)5-8;1-7(2)8-3-5-9-6-4-8/h10H,3-9H2,1-2H3;7-9H,5-6H2,1-4H3;4*8-10H,3-7H2,1-2H3;7H,3-6H2,1-2H3;2*7-9H,3-6H2,1-2H3;8H,3-7H2,1-2H3;7-8H,4-6H2,1-3H3;4*7-9H,3-6H2,1-2H3;8H,3-7H2,1-2H3;9H,3-8H2,1-2H3;5-7H,3-4H2,1-2H3;6-8H,3-5H2,1-2H3;7H,5-6H2,1-4H3;7,10H,4-6H2,1-3H3;6-8H,3-5H2,1-2H3;7H,5-6H2,1-4H3;6,9H,4-5H2,1-3H3;7H,3-6H2,1-2H3/t;;;;;;;;;;;;;2*8-,9+;;;;;;;;;;/m..............0........../s1
InChIKeyGSGPSZCVEGIMSQ-ACCVSHHESA-N
XLogP41.30
TPSA176.84 Ų
H-Bond Donors2
H-Bond Acceptors33
Rotatable Bonds27
Heavy Atoms259
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003651.02
LogP ≤ 541.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1033

Analyze 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane with MolForge

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What is the IUPAC name of 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane?
The IUPAC name of 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane (CID 158350626) is 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane.
What is the SMILES notation for 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane?
The canonical SMILES for 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane is CC(C)N1C2CCCC1CC2.CC(C)N1C2CCCC1CC2.CC(C)N1C2COCC1C2.CC(C)N1CC(C)(C)C1.CC(C)N1CC(C)(CO)C1.CC(C)N1CC(C)(O)C1.CC(C)N1CC2(CCC2)C1.CC(C)N1CC2C(C1)C2(C)C.CC(C)N1CC2C(C1)C2(F)F.CC(C)N1CC2CC(C2)C1.CC(C)N1CC2CC2(C)C1.CC(C)N1CC2CC2C1.CC(C)N1CC2CCC(C1)O2.CC(C)N1CC2CCC(C2)C1.CC(C)N1CC2CCC1CC2.CC(C)N1CC2CCC1CO2.CC(C)N1CCC2(C1)CC2(F)F.CC(C)N1CCC2CC2C1.CC(C)N1CCCC2(CCC2)C1.CC(C)N1CCCCCC1.CC(C)N1CCOC2(CC2)C1.CC(C)N1CCOCC1.CC(C)N1C[C@H]2CC[C@@H]1C2.CC(C)N1C[C@H]2CC[C@H]2C1.COC1(C)CN(C(C)C)C1.
What is the InChIKey of 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane?
The InChIKey is GSGPSZCVEGIMSQ-ACCVSHHESA-N. The full InChI is InChI=1S/C11H21N.5C10H19N.C9H15F2N.3C9H17NO.6C9H17N.C9H19N.C8H13F2N.C8H15NO.2C8H17NO.C8H15N.C8H17N.2C7H15NO/c1-10(2)12-8-4-7-11(9-12)5-3-6-11;1-7(2)11-5-8-9(6-11)10(8,3)4;1-8(2)11-7-9-3-5-10(11)6-4-9;1-8(2)11-6-9-3-4-10(5-9)7-11;2*1-8(2)11-9-4-3-5-10(11)7-6-9;1-7(2)12-4-3-8(6-12)5-9(8,10)11;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)10-5-6-11-9(7-10)3-4-9;1-7(2)10-5-8-4-9(8,3)6-10;1-7(2)10-5-8-3-9(4-8)6-10;1-7(2)10-4-3-8-5-9(8)6-10;1-7(2)10-5-8-3-4-9(8)6-10;1-7(2)10-6-8-3-4-9(10)5-8;1-8(2)10-6-9(7-10)4-3-5-9;1-9(2)10-7-5-3-4-6-8-10;1-5(2)11-3-6-7(4-11)8(6,9)10;1-6(2)9-7-3-8(9)5-10-4-7;1-7(2)9-5-8(3,6-9)10-4;1-7(2)9-4-8(3,5-9)6-10;1-6(2)9-4-7-3-8(7)5-9;1-7(2)9-5-8(3,4)6-9;1-6(2)8-4-7(3,9)5-8;1-7(2)8-3-5-9-6-4-8/h10H,3-9H2,1-2H3;7-9H,5-6H2,1-4H3;4*8-10H,3-7H2,1-2H3;7H,3-6H2,1-2H3;2*7-9H,3-6H2,1-2H3;8H,3-7H2,1-2H3;7-8H,4-6H2,1-3H3;4*7-9H,3-6H2,1-2H3;8H,3-7H2,1-2H3;9H,3-8H2,1-2H3;5-7H,3-4H2,1-2H3;6-8H,3-5H2,1-2H3;7H,5-6H2,1-4H3;7,10H,4-6H2,1-3H3;6-8H,3-5H2,1-2H3;7H,5-6H2,1-4H3;6,9H,4-5H2,1-3H3;7H,3-6H2,1-2H3/t;;;;;;;;;;;;;2*8-,9+;;;;;;;;;;/m..............0........../s1.
What are the key properties of 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane?
6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane has a molecular weight of 3651.02 g/mol, XLogP of 41.30, 27 rotatable bonds, 2 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;2,2-difluoro-5-propan-2-yl-5-azaspiro[2.4]heptane;6,6-dimethyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-dimethyl-1-propan-2-ylazetidine;3-methoxy-3-methyl-1-propan-2-ylazetidine;1-methyl-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3-methyl-1-propan-2-ylazetidin-3-ol;(3-methyl-1-propan-2-ylazetidin-3-yl)methanol;(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;bis(8-propan-2-yl-8-azabicyclo[3.2.1]octane);2-propan-2-yl-2-azaspiro[3.3]heptane;6-propan-2-yl-6-azaspiro[3.5]nonane;1-propan-2-ylazepane;4-propan-2-ylmorpholine;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]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;7-propan-2-yl-4-oxa-7-azaspiro[2.5]octane is sourced from PubChem (CID 158350626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).