2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole

C182H336F9N27O5S — CID 161475652

IUPAC2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole
SMILESCC(=O)C1C2CN(C(C)(C)C)CC21.CC(=O)C1[C@H]2CN(C(C)(C)C)C[C@@H]12.CC(C)(C)N1CCC(C(N)=O)C1.CC(C)(C)N1CCC(F)(F)C1.CC(C)(C)N1CCC(S(C)(=O)=O)C1.CC(C)(C)N1CCC(c2ccc[nH]2)C1.CC(C)(C)N1CCC2CC21.CC(C)(C)N1C[C@@H](F)[C@@H](F)C1.CC(C)(C)N1Cc2cccnc2C1.CC(F)(F)C1CCN(C(C)(C)C)C1.CC1(F)CCN(C(C)(C)C)C1.CC1CN(C(C)(C)C)CC1(F)F.CC[C@]1(C)CCN(C(C)(C)C)C1.C[C@@H]1CCN(C(C)(C)C)C1.C[C@H]1CCN(C(C)(C)C)C1.Cc1nccc(C2CCN(C(C)(C)C)C2)n1.Cn1ccnc1C1CCN(C(C)(C)C)C1.Cn1cncc1C1CCN(C(C)(C)C)C1
InChIInChI=1S/C13H21N3.2C12H21N3.C12H20N2.C11H16N2.2C11H19NO.C11H23N.C10H19F2N.C9H17F2N.C9H18FN.C9H18N2O.C9H19NO2S.C9H17N.2C9H19N.2C8H15F2N/c1-10-14-7-5-12(15-10)11-6-8-16(9-11)13(2,3)4;1-12(2,3)15-7-5-10(9-15)11-13-6-8-14(11)4;1-12(2,3)15-6-5-10(8-15)11-7-13-9-14(11)4;1-12(2,3)14-8-6-10(9-14)11-5-4-7-13-11;1-11(2,3)13-7-9-5-4-6-12-10(9)8-13;2*1-7(13)10-8-5-12(6-9(8)10)11(2,3)4;1-6-11(5)7-8-12(9-11)10(2,3)4;1-9(2,3)13-6-5-8(7-13)10(4,11)12;1-7-5-12(8(2,3)4)6-9(7,10)11;1-8(2,3)11-6-5-9(4,10)7-11;1-9(2,3)11-5-4-7(6-11)8(10)12;1-9(2,3)10-6-5-8(7-10)13(4,11)12;1-9(2,3)10-5-4-7-6-8(7)10;2*1-8-5-6-10(7-8)9(2,3)4;1-8(2,3)11-4-6(9)7(10)5-11;1-7(2,3)11-5-4-8(9,10)6-11/h5,7,11H,6,8-9H2,1-4H3;6,8,10H,5,7,9H2,1-4H3;7,9-10H,5-6,8H2,1-4H3;4-5,7,10,13H,6,8-9H2,1-3H3;4-6H,7-8H2,1-3H3;2*8-10H,5-6H2,1-4H3;6-9H2,1-5H3;8H,5-7H2,1-4H3;7H,5-6H2,1-4H3;5-7H2,1-4H3;7H,4-6H2,1-3H3,(H2,10,12);8H,5-7H2,1-4H3;7-8H,4-6H2,1-3H3;2*8H,5-7H2,1-4H3;6-7H,4-5H2,1-3H3;4-6H2,1-3H3/t;;;;;8-,9+,10?;;11-;;;;;;;2*8-;6-,7+;/m.......1......10../s1
InChIKeyWDRFJWCXZLWGKL-VJMODDAPSA-N
MW3185.92 g/mol
LogP36.08
Rot. Bonds10

About 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole

2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole (PubChem CID 161475652) has the molecular formula C182H336F9N27O5S and a molecular weight of 3185.92 g/mol. Its IUPAC name is 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole.

Molecular Properties

Compound Name2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole
PubChem CID161475652
Molecular FormulaC182H336F9N27O5S
Molecular Weight3185.92 g/mol
Exact Mass3183.64
IUPAC Name2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole
SMILESCC(=O)C1C2CN(C(C)(C)C)CC21.CC(=O)C1[C@H]2CN(C(C)(C)C)C[C@@H]12.CC(C)(C)N1CCC(C(N)=O)C1.CC(C)(C)N1CCC(F)(F)C1.CC(C)(C)N1CCC(S(C)(=O)=O)C1.CC(C)(C)N1CCC(c2ccc[nH]2)C1.CC(C)(C)N1CCC2CC21.CC(C)(C)N1C[C@@H](F)[C@@H](F)C1.CC(C)(C)N1Cc2cccnc2C1.CC(F)(F)C1CCN(C(C)(C)C)C1.CC1(F)CCN(C(C)(C)C)C1.CC1CN(C(C)(C)C)CC1(F)F.CC[C@]1(C)CCN(C(C)(C)C)C1.C[C@@H]1CCN(C(C)(C)C)C1.C[C@H]1CCN(C(C)(C)C)C1.Cc1nccc(C2CCN(C(C)(C)C)C2)n1.Cn1ccnc1C1CCN(C(C)(C)C)C1.Cn1cncc1C1CCN(C(C)(C)C)C1
InChIInChI=1S/C13H21N3.2C12H21N3.C12H20N2.C11H16N2.2C11H19NO.C11H23N.C10H19F2N.C9H17F2N.C9H18FN.C9H18N2O.C9H19NO2S.C9H17N.2C9H19N.2C8H15F2N/c1-10-14-7-5-12(15-10)11-6-8-16(9-11)13(2,3)4;1-12(2,3)15-7-5-10(9-15)11-13-6-8-14(11)4;1-12(2,3)15-6-5-10(8-15)11-7-13-9-14(11)4;1-12(2,3)14-8-6-10(9-14)11-5-4-7-13-11;1-11(2,3)13-7-9-5-4-6-12-10(9)8-13;2*1-7(13)10-8-5-12(6-9(8)10)11(2,3)4;1-6-11(5)7-8-12(9-11)10(2,3)4;1-9(2,3)13-6-5-8(7-13)10(4,11)12;1-7-5-12(8(2,3)4)6-9(7,10)11;1-8(2,3)11-6-5-9(4,10)7-11;1-9(2,3)11-5-4-7(6-11)8(10)12;1-9(2,3)10-6-5-8(7-10)13(4,11)12;1-9(2,3)10-5-4-7-6-8(7)10;2*1-8-5-6-10(7-8)9(2,3)4;1-8(2,3)11-4-6(9)7(10)5-11;1-7(2,3)11-5-4-8(9,10)6-11/h5,7,11H,6,8-9H2,1-4H3;6,8,10H,5,7,9H2,1-4H3;7,9-10H,5-6,8H2,1-4H3;4-5,7,10,13H,6,8-9H2,1-3H3;4-6H,7-8H2,1-3H3;2*8-10H,5-6H2,1-4H3;6-9H2,1-5H3;8H,5-7H2,1-4H3;7H,5-6H2,1-4H3;5-7H2,1-4H3;7H,4-6H2,1-3H3,(H2,10,12);8H,5-7H2,1-4H3;7-8H,4-6H2,1-3H3;2*8H,5-7H2,1-4H3;6-7H,4-5H2,1-3H3;4-6H2,1-3H3/t;;;;;8-,9+,10?;;11-;;;;;;;2*8-;6-,7+;/m.......1......10../s1
InChIKeyWDRFJWCXZLWGKL-VJMODDAPSA-N
XLogP36.08
TPSA259.79 Ų
H-Bond Donors2
H-Bond Acceptors30
Rotatable Bonds10
Heavy Atoms224
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003185.92
LogP ≤ 536.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1030

Analyze 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole with MolForge

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Related Compounds

(2R,4S)-4-fluoro-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3,5-triazin-2-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide;(2S,4S)-4-fluoro-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3,5-triazin-2-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide;(4R)-3-[2-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]-N-(2,2,2-trifluoroethyl)-1,3-thiazolidine-4-carboxamide;(2R)-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3,5-triazin-2-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 157154839
2-tert-butyl-2-azabicyclo[3.1.0]hexane;(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexane-6-carboxamide;1-[(1S,5R)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)propan-1-one;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R,4R)-1-tert-butyl-3-fluoro-4-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-(1-tert-butylpyrrolidin-3-yl)ethanone;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;3-(1-tert-butylpyrrolidin-3-yl)-2H-pyrrole
CID 157987534
N-[[1-cyclopropyl-4-[2-[6-(difluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]-3-methylpiperazin-2-yl]methyl]methanesulfonamide;3-[4-[4-[(2-methylcyclopropyl)methyl]-3-(1H-pyrazol-4-yl)piperazin-1-yl]pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyridine;N-[[(2S,3S)-3-methyl-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperazin-2-yl]methyl]methanesulfonamide;3-[4-[3-(1H-pyrazol-4-yl)-4-(spiro[2.2]pentan-2-ylmethyl)piperazin-1-yl]pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyridine;(3R)-3-[(2S)-2-(1H-pyrazol-4-yl)-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperazine-1-carbonyl]cyclohexan-1-one
CID 158969208
N-[[(2R,3S,6S)-1-cyclopropyl-3,6-dimethyl-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperazin-2-yl]methyl]methanesulfonamide;N-[[(2S,3S,6S)-1-cyclopropyl-3,6-dimethyl-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperazin-2-yl]methyl]methanesulfonamide;N-[[(2S,3R,6R)-1-cyclopropyl-3,6-dimethyl-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperazin-2-yl]methyl]methanesulfonamide;4-[2,2-dimethyl-4-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-yl]piperazine-1-carbonyl]cyclohexan-1-one;3-[4-[(3S)-4-(3-methylsulfonylcyclobutyl)-3-(1H-pyrazol-4-yl)piperazin-1-yl]pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 158975962
(1S,5R)-N-[2-(1-cyclopropyl-8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-(1,8-dimethylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-(1-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-[8-methyl-1-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-[7-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1R,5S)-N-[2-[8-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 160071738
(1S,5R)-N-[2-(3-cyclopropyl-7aH-inden-1-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-(1-cyclopropyl-8-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-(1-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-[8-methyl-1-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-[6-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-[7-(trifluoromethyl)imidazo[1,5-a]pyridin-3-yl]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 160483496
1-[4-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-2-yl]-4,4-difluoro-5-methyl-N-methylsulfonylpiperidine-3-carboxamide;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-N-methylpiperidine-3-carboxamide;1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;3-[1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidin-3-yl]propanamide;6-(difluoromethyl)-3-[4-[3-(3-methylsulfonylpropyl)piperidin-1-yl]pyrimidin-2-yl]imidazo[1,2-a]pyrazine
CID 160534184
2-tert-butyl-2-azabicyclo[3.1.0]hexane;bis((1S,5R)-3-tert-butyl-3-azabicyclo[3.1.0]hexane-6-carboxamide);1-[(1S,5R)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)propan-1-one;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;(4S)-1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;2-tert-butyl-3,6-dihydro-1H-cyclopenta[c]pyrrole;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;3-(1-tert-butylpyrrolidin-3-yl)-2H-pyrrole
CID 161045477
tris([1-[2-[6-(difluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-2,5-dimethylpiperidin-3-yl]methyl-imino-methyl-oxo-lambda6-sulfane);bis(3-[2-[2,5-dimethyl-3-(2H-pyrrol-4-yl)piperazin-1-yl]pyrimidin-4-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyrazine)
CID 161338536
3-[4-[3-(1H-imidazol-5-yl)-2,5-dimethylpiperazin-1-yl]pyrimidin-2-yl]-6-(trifluoromethyl)imidazo[1,2-a]pyrazine;3-methyl-1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide;4-[1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]-3,6-dihydro-2H-pyridin-5-yl]-1,2-thiazole;1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]piperidine-3-sulfonamide;N-[[1-[2-[6-(trifluoromethyl)imidazo[1,2-a]pyrazin-3-yl]pyrimidin-4-yl]pyrrolidin-3-yl]methyl]acetamide
CID 161523230
[1-[4-[6-(difluoromethyl)imidazo[1,2-b]pyridazin-3-yl]-2-pyridinyl]-3,4-dihydro-2H-pyridin-3-yl]imino-dimethyl-oxo-lambda6-sulfane;tris(2,5-dimethyl-1-[6-[6-(trifluoromethyl)imidazo[1,2-b]pyridazin-3-yl]pyrimidin-4-yl]piperidine-3-carboxamide);3-[6-[3-(1H-imidazol-5-yl)piperidin-1-yl]pyrimidin-4-yl]-6-(trifluoromethyl)imidazo[1,2-b]pyridazine
CID 161620445
(4S)-N-(2,2-difluoropropyl)-3-[2-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]-1,3-thiazolidine-4-carboxamide;(2R,4S)-4-fluoro-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3,5-triazin-2-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide;(2S,4S)-4-fluoro-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3,5-triazin-2-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide;(4R)-3-[2-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-4-yl]-N-(2,2,2-trifluoroethyl)-1,3-thiazolidine-4-carboxamide;(2R)-1-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-1,3,5-triazin-2-yl]-N-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 161854654

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole?
The IUPAC name of 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole (CID 161475652) is 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole.
What is the SMILES notation for 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole?
The canonical SMILES for 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole is CC(=O)C1C2CN(C(C)(C)C)CC21.CC(=O)C1[C@H]2CN(C(C)(C)C)C[C@@H]12.CC(C)(C)N1CCC(C(N)=O)C1.CC(C)(C)N1CCC(F)(F)C1.CC(C)(C)N1CCC(S(C)(=O)=O)C1.CC(C)(C)N1CCC(c2ccc[nH]2)C1.CC(C)(C)N1CCC2CC21.CC(C)(C)N1C[C@@H](F)[C@@H](F)C1.CC(C)(C)N1Cc2cccnc2C1.CC(F)(F)C1CCN(C(C)(C)C)C1.CC1(F)CCN(C(C)(C)C)C1.CC1CN(C(C)(C)C)CC1(F)F.CC[C@]1(C)CCN(C(C)(C)C)C1.C[C@@H]1CCN(C(C)(C)C)C1.C[C@H]1CCN(C(C)(C)C)C1.Cc1nccc(C2CCN(C(C)(C)C)C2)n1.Cn1ccnc1C1CCN(C(C)(C)C)C1.Cn1cncc1C1CCN(C(C)(C)C)C1.
What is the InChIKey of 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole?
The InChIKey is WDRFJWCXZLWGKL-VJMODDAPSA-N. The full InChI is InChI=1S/C13H21N3.2C12H21N3.C12H20N2.C11H16N2.2C11H19NO.C11H23N.C10H19F2N.C9H17F2N.C9H18FN.C9H18N2O.C9H19NO2S.C9H17N.2C9H19N.2C8H15F2N/c1-10-14-7-5-12(15-10)11-6-8-16(9-11)13(2,3)4;1-12(2,3)15-7-5-10(9-15)11-13-6-8-14(11)4;1-12(2,3)15-6-5-10(8-15)11-7-13-9-14(11)4;1-12(2,3)14-8-6-10(9-14)11-5-4-7-13-11;1-11(2,3)13-7-9-5-4-6-12-10(9)8-13;2*1-7(13)10-8-5-12(6-9(8)10)11(2,3)4;1-6-11(5)7-8-12(9-11)10(2,3)4;1-9(2,3)13-6-5-8(7-13)10(4,11)12;1-7-5-12(8(2,3)4)6-9(7,10)11;1-8(2,3)11-6-5-9(4,10)7-11;1-9(2,3)11-5-4-7(6-11)8(10)12;1-9(2,3)10-6-5-8(7-10)13(4,11)12;1-9(2,3)10-5-4-7-6-8(7)10;2*1-8-5-6-10(7-8)9(2,3)4;1-8(2,3)11-4-6(9)7(10)5-11;1-7(2,3)11-5-4-8(9,10)6-11/h5,7,11H,6,8-9H2,1-4H3;6,8,10H,5,7,9H2,1-4H3;7,9-10H,5-6,8H2,1-4H3;4-5,7,10,13H,6,8-9H2,1-3H3;4-6H,7-8H2,1-3H3;2*8-10H,5-6H2,1-4H3;6-9H2,1-5H3;8H,5-7H2,1-4H3;7H,5-6H2,1-4H3;5-7H2,1-4H3;7H,4-6H2,1-3H3,(H2,10,12);8H,5-7H2,1-4H3;7-8H,4-6H2,1-3H3;2*8H,5-7H2,1-4H3;6-7H,4-5H2,1-3H3;4-6H2,1-3H3/t;;;;;8-,9+,10?;;11-;;;;;;;2*8-;6-,7+;/m.......1......10../s1.
What are the key properties of 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole?
2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole has a molecular weight of 3185.92 g/mol, XLogP of 36.08, 10 rotatable bonds, 2 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-2-azabicyclo[3.1.0]hexane;1-[(1R,5S)-3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl]ethanone;1-(3-tert-butyl-3-azabicyclo[3.1.0]hexan-6-yl)ethanone;1-tert-butyl-3-(1,1-difluoroethyl)pyrrolidine;1-tert-butyl-3,3-difluoro-4-methylpyrrolidine;1-tert-butyl-3,3-difluoropyrrolidine;(3S,4R)-1-tert-butyl-3,4-difluoropyrrolidine;6-tert-butyl-5,7-dihydropyrrolo[3,4-b]pyridine;(3R)-1-tert-butyl-3-ethyl-3-methylpyrrolidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;(3R)-1-tert-butyl-3-methylpyrrolidine;(3S)-1-tert-butyl-3-methylpyrrolidine;1-tert-butyl-3-methylsulfonylpyrrolidine;1-tert-butylpyrrolidine-3-carboxamide;2-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;5-(1-tert-butylpyrrolidin-3-yl)-1-methylimidazole;4-(1-tert-butylpyrrolidin-3-yl)-2-methylpyrimidine;2-(1-tert-butylpyrrolidin-3-yl)-1H-pyrrole is sourced from PubChem (CID 161475652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).