3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane

C185H343N17O16 — CID 163582280

IUPAC3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane
SMILESC#CC1(O)C2CCC1CN(C(C)C)C2.CC(C)N1C2CC3CC(C2)CC1C3.CC(C)N1C2CC3CC1CC(C2)O3.CC(C)N1C2CCC1CC(O)C2.CC(C)N1C2CCC1CC(O)C2.CC(C)N1C2CCCC1CC(O)C2.CC(C)N1C2COCC1CC(O)C2.CC(C)N1CC2CC3CC(C2)CC1C3.CC(C)N1CC2CCC(C1)C2(C)O.CC(C)N1CC2CCC(C1)C2(C)O.CC(C)N1CC2CCC(C1)C2(O)C(C)C.CC(C)N1CC2CCC(C1)C2O.CC(C)N1CC2CCC(C1)C2O.CC(C)N1CC2CCC(C1)OC2.CC(C)N1C[C@H]2C[C@@H]1CC2(C)O.CC(C)N1C[C@H]2C[C@@H]1CC2O.CCC1(O)C2CCC1CN(C(C)C)C2
InChIInChI=1S/C13H25NO.C13H23N.C12H23NO.C12H19NO.C12H21N.C11H19NO.3C11H21NO.C10H19NO2.6C10H19NO.C9H17NO/c1-9(2)13(15)11-5-6-12(13)8-14(7-11)10(3)4;1-9(2)14-8-12-4-10-3-11(5-12)7-13(14)6-10;2*1-4-12(14)10-5-6-11(12)8-13(7-10)9(2)3;1-8(2)13-11-4-9-3-10(6-11)7-12(13)5-9;1-7(2)12-8-3-10-5-9(12)6-11(4-8)13-10;2*1-8(2)12-6-9-4-5-10(7-12)11(9,3)13;1-8(2)12-9-4-3-5-10(12)7-11(13)6-9;1-7(2)11-8-3-10(12)4-9(11)6-13-5-8;1-7(2)11-6-8-4-9(11)5-10(8,3)12;1-8(2)11-5-9-3-4-10(6-11)12-7-9;2*1-7(2)11-5-8-3-4-9(6-11)10(8)12;2*1-7(2)11-8-3-4-9(11)6-10(12)5-8;1-6(2)10-5-7-3-8(10)4-9(7)11/h9-12,15H,5-8H2,1-4H3;9-13H,3-8H2,1-2H3;9-11,14H,4-8H2,1-3H3;1,9-11,14H,5-8H2,2-3H3;8-12H,3-7H2,1-2H3;7-11H,3-6H2,1-2H3;2*8-10,13H,4-7H2,1-3H3;8-11,13H,3-7H2,1-2H3;7-10,12H,3-6H2,1-2H3;7-9,12H,4-6H2,1-3H3;8-10H,3-7H2,1-2H3;4*7-10,12H,3-6H2,1-2H3;6-9,11H,3-5H2,1-2H3/t;;;;;;;;;;8-,9-,10?;;;;;;7-,8-,9?/m..........1.....1/s1
InChIKeyGIODGXFSFJCUAN-DULHQYESSA-N
MW3061.88 g/mol
LogP26.38
Rot. Bonds19

About 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane

3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane (PubChem CID 163582280) has the molecular formula C185H343N17O16 and a molecular weight of 3061.88 g/mol. Its IUPAC name is 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane.

Molecular Properties

Compound Name3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane
PubChem CID163582280
Molecular FormulaC185H343N17O16
Molecular Weight3061.88 g/mol
Exact Mass3059.65
IUPAC Name3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane
SMILESC#CC1(O)C2CCC1CN(C(C)C)C2.CC(C)N1C2CC3CC(C2)CC1C3.CC(C)N1C2CC3CC1CC(C2)O3.CC(C)N1C2CCC1CC(O)C2.CC(C)N1C2CCC1CC(O)C2.CC(C)N1C2CCCC1CC(O)C2.CC(C)N1C2COCC1CC(O)C2.CC(C)N1CC2CC3CC(C2)CC1C3.CC(C)N1CC2CCC(C1)C2(C)O.CC(C)N1CC2CCC(C1)C2(C)O.CC(C)N1CC2CCC(C1)C2(O)C(C)C.CC(C)N1CC2CCC(C1)C2O.CC(C)N1CC2CCC(C1)C2O.CC(C)N1CC2CCC(C1)OC2.CC(C)N1C[C@H]2C[C@@H]1CC2(C)O.CC(C)N1C[C@H]2C[C@@H]1CC2O.CCC1(O)C2CCC1CN(C(C)C)C2
InChIInChI=1S/C13H25NO.C13H23N.C12H23NO.C12H19NO.C12H21N.C11H19NO.3C11H21NO.C10H19NO2.6C10H19NO.C9H17NO/c1-9(2)13(15)11-5-6-12(13)8-14(7-11)10(3)4;1-9(2)14-8-12-4-10-3-11(5-12)7-13(14)6-10;2*1-4-12(14)10-5-6-11(12)8-13(7-10)9(2)3;1-8(2)13-11-4-9-3-10(6-11)7-12(13)5-9;1-7(2)12-8-3-10-5-9(12)6-11(4-8)13-10;2*1-8(2)12-6-9-4-5-10(7-12)11(9,3)13;1-8(2)12-9-4-3-5-10(12)7-11(13)6-9;1-7(2)11-8-3-10(12)4-9(11)6-13-5-8;1-7(2)11-6-8-4-9(11)5-10(8,3)12;1-8(2)11-5-9-3-4-10(6-11)12-7-9;2*1-7(2)11-5-8-3-4-9(6-11)10(8)12;2*1-7(2)11-8-3-4-9(11)6-10(12)5-8;1-6(2)10-5-7-3-8(10)4-9(7)11/h9-12,15H,5-8H2,1-4H3;9-13H,3-8H2,1-2H3;9-11,14H,4-8H2,1-3H3;1,9-11,14H,5-8H2,2-3H3;8-12H,3-7H2,1-2H3;7-11H,3-6H2,1-2H3;2*8-10,13H,4-7H2,1-3H3;8-11,13H,3-7H2,1-2H3;7-10,12H,3-6H2,1-2H3;7-9,12H,4-6H2,1-3H3;8-10H,3-7H2,1-2H3;4*7-10,12H,3-6H2,1-2H3;6-9,11H,3-5H2,1-2H3/t;;;;;;;;;;8-,9-,10?;;;;;;7-,8-,9?/m..........1.....1/s1
InChIKeyGIODGXFSFJCUAN-DULHQYESSA-N
XLogP26.38
TPSA345.76 Ų
H-Bond Donors13
H-Bond Acceptors33
Rotatable Bonds19
Heavy Atoms218
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003061.88
LogP ≤ 526.38
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

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
2-propan-2-yl-2-azabicyclo[2.2.1]heptane;3-propan-2-yl-3-azabicyclo[3.2.1]octane;8-propan-2-yl-8-azabicyclo[3.2.1]octane;1-(3-propan-2-yl-3,6-diazabicyclo[3.1.1]heptan-6-yl)ethanone
CID 165053063
(1R,5R)-3-propan-2-yl-3-azabicyclo[3.3.1]nonan-9-ol
CID 98053872
(1S,5S)-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol
CID 98053860
6-propan-2-yl-6-azabicyclo[3.2.1]octan-2-ol
CID 117050678
2-propan-2-yl-3-(6-propan-2-yl-6-azabicyclo[3.2.2]nonan-8-yl)-2-azabicyclo[3.2.2]nonane
CID 170004182
3-propan-2-yl-6-oxa-3-azabicyclo[3.1.1]heptane;6-propan-2-yl-3-oxa-6-azabicyclo[3.1.1]heptane;10-propan-2-yl-8-oxa-3,10-diazabicyclo[4.3.1]decan-4-one
CID 158775151
3-propan-2-yl-3-azabicyclo[3.1.0]hexane;8-propan-2-yl-8-azabicyclo[3.2.1]octane;1-propan-2-yl-1-azaspiro[3.3]heptane;5-propan-2-yl-5-azaspiro[2.4]heptane;1-propan-2-ylazetidine;4-propan-2-yl-3,6-dihydro-2H-pyran;4-propan-2-ylmorpholine;5-propan-2-yl-2-oxa-5-azabicyclo[2.2.2]octane;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine;4-propan-2-yl-1,4-thiazinane 1,1-dioxide
CID 158905238
3-[5-methyl-5-(3-oxabicyclo[3.2.1]octan-8-yl)hexan-2-yl]-3-azabicyclo[3.1.1]heptane
CID 129146206
7,9-di(propan-2-yl)-3-oxa-7,9-diazabicyclo[3.3.1]nonane
CID 146275691
3-propan-2-yl-3-azabicyclo[3.1.1]heptane;2-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;3-propan-2-yl-3,6-diazabicyclo[3.1.1]heptane;3-propan-2-yl-3,8-diazabicyclo[3.2.1]octane;8-propan-2-yl-3,8-diazabicyclo[3.2.1]octane
CID 162040228
3,3-difluoro-6-propan-2-yl-6-azabicyclo[3.1.1]heptane;5,5-difluoro-2-propan-2-yl-2-azabicyclo[2.2.1]heptane;6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.1]heptane;methane
CID 163454860

Frequently Asked Questions

What is the IUPAC name of 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane?
The IUPAC name of 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane (CID 163582280) is 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane.
What is the SMILES notation for 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane?
The canonical SMILES for 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane is C#CC1(O)C2CCC1CN(C(C)C)C2.CC(C)N1C2CC3CC(C2)CC1C3.CC(C)N1C2CC3CC1CC(C2)O3.CC(C)N1C2CCC1CC(O)C2.CC(C)N1C2CCC1CC(O)C2.CC(C)N1C2CCCC1CC(O)C2.CC(C)N1C2COCC1CC(O)C2.CC(C)N1CC2CC3CC(C2)CC1C3.CC(C)N1CC2CCC(C1)C2(C)O.CC(C)N1CC2CCC(C1)C2(C)O.CC(C)N1CC2CCC(C1)C2(O)C(C)C.CC(C)N1CC2CCC(C1)C2O.CC(C)N1CC2CCC(C1)C2O.CC(C)N1CC2CCC(C1)OC2.CC(C)N1C[C@H]2C[C@@H]1CC2(C)O.CC(C)N1C[C@H]2C[C@@H]1CC2O.CCC1(O)C2CCC1CN(C(C)C)C2.
What is the InChIKey of 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane?
The InChIKey is GIODGXFSFJCUAN-DULHQYESSA-N. The full InChI is InChI=1S/C13H25NO.C13H23N.C12H23NO.C12H19NO.C12H21N.C11H19NO.3C11H21NO.C10H19NO2.6C10H19NO.C9H17NO/c1-9(2)13(15)11-5-6-12(13)8-14(7-11)10(3)4;1-9(2)14-8-12-4-10-3-11(5-12)7-13(14)6-10;2*1-4-12(14)10-5-6-11(12)8-13(7-10)9(2)3;1-8(2)13-11-4-9-3-10(6-11)7-12(13)5-9;1-7(2)12-8-3-10-5-9(12)6-11(4-8)13-10;2*1-8(2)12-6-9-4-5-10(7-12)11(9,3)13;1-8(2)12-9-4-3-5-10(12)7-11(13)6-9;1-7(2)11-8-3-10(12)4-9(11)6-13-5-8;1-7(2)11-6-8-4-9(11)5-10(8,3)12;1-8(2)11-5-9-3-4-10(6-11)12-7-9;2*1-7(2)11-5-8-3-4-9(6-11)10(8)12;2*1-7(2)11-8-3-4-9(11)6-10(12)5-8;1-6(2)10-5-7-3-8(10)4-9(7)11/h9-12,15H,5-8H2,1-4H3;9-13H,3-8H2,1-2H3;9-11,14H,4-8H2,1-3H3;1,9-11,14H,5-8H2,2-3H3;8-12H,3-7H2,1-2H3;7-11H,3-6H2,1-2H3;2*8-10,13H,4-7H2,1-3H3;8-11,13H,3-7H2,1-2H3;7-10,12H,3-6H2,1-2H3;7-9,12H,4-6H2,1-3H3;8-10H,3-7H2,1-2H3;4*7-10,12H,3-6H2,1-2H3;6-9,11H,3-5H2,1-2H3/t;;;;;;;;;;8-,9-,10?;;;;;;7-,8-,9?/m..........1.....1/s1.
What are the key properties of 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane?
3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane has a molecular weight of 3061.88 g/mol, XLogP of 26.38, 19 rotatable bonds, 13 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 3,8-di(propan-2-yl)-3-azabicyclo[3.2.1]octan-8-ol;8-ethyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;8-ethynyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol;(1R,4R)-5-methyl-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;bis(8-methyl-3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);(1R,4R)-2-propan-2-yl-2-azabicyclo[2.2.1]heptan-5-ol;9-propan-2-yl-9-azabicyclo[3.3.1]nonan-3-ol;bis(3-propan-2-yl-3-azabicyclo[3.2.1]octan-8-ol);bis(8-propan-2-yl-8-azabicyclo[3.2.1]octan-3-ol);2-propan-2-yl-2-azatricyclo[3.3.1.13,7]decane;4-propan-2-yl-4-azatricyclo[4.3.1.13,8]undecane;3-propan-2-yl-6-oxa-3-azabicyclo[3.2.2]nonane;9-propan-2-yl-3-oxa-9-azabicyclo[3.3.1]nonan-7-ol;6-propan-2-yl-2-oxa-6-azatricyclo[3.3.1.13,7]decane is sourced from PubChem (CID 163582280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).