3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine

C242H520F5N27 — CID 159787240

IUPAC3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
SMILESC.C.C.C.C.C.C.C.C.C.CC(C)N1CC2CC2C1.CC(C)N1CC2CCC2C1.CC(C)N1CC2CCCCC2C1.CC(C)N1CCC(C)(C)C1.CC(C)N1CCC(C)(C)CC1.CC(C)N1CCC(C)(F)CC1.CC(C)N1CCC(F)(F)C1.CC(C)N1CCCC(C)(C)C1.CC(C)N1CCCC(C)(F)C1.CC(C)N1CCCC1.CC(C)N1CCCC1(C)C.CC(C)N1CCCCC1.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@@H](F)C1.CC(C)N1CCC[C@@H]1C.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H]1C.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1C[C@H](C)[C@@H](C)C1.CC1CCN(C(C)C)CC1.CC1CCN(C(C)C)CC1
InChIInChI=1S/C11H21N.2C10H21N.2C9H18FN.C9H17N.8C9H19N.C8H16FN.C8H15N.9C8H17N.C7H13F2N.C7H15N.10CH4/c1-9(2)12-7-10-5-3-4-6-11(10)8-12;1-9(2)11-7-5-10(3,4)6-8-11;1-9(2)11-7-5-6-10(3,4)8-11;1-8(2)11-6-4-9(3,10)5-7-11;1-8(2)11-6-4-5-9(3,10)7-11;1-7(2)10-5-8-3-4-9(8)6-10;1-7(2)10-5-8(3)9(4)6-10;1-8(2)10-6-5-9(3,4)7-10;1-8(2)10-7-5-6-9(10,3)4;2*1-8(2)10-6-4-9(3)5-7-10;3*1-8(2)10-6-4-5-9(3)7-10;1-7(2)10-5-3-4-8(9)6-10;1-6(2)9-4-7-3-8(7)5-9;6*1-7(2)9-5-4-8(3)6-9;2*1-7(2)9-6-4-5-8(9)3;1-8(2)9-6-4-3-5-7-9;1-6(2)10-4-3-7(8,9)5-10;1-7(2)8-5-3-4-6-8;;;;;;;;;;/h9-11H,3-8H2,1-2H3;2*9H,5-8H2,1-4H3;2*8H,4-7H2,1-3H3;7-9H,3-6H2,1-2H3;7-9H,5-6H2,1-4H3;2*8H,5-7H2,1-4H3;5*8-9H,4-7H2,1-3H3;7-8H,3-6H2,1-2H3;6-8H,3-5H2,1-2H3;8*7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3;6H,3-5H2,1-2H3;7H,3-6H2,1-2H3;10*1H4/t;;;;;;8-,9-;;;;;3*9-;8-;;8*8-;;;;;;;;;;;;;/m......0....1001.11100010............./s1
InChIKeyNICJPVPOCWVDQD-GSZYZGARSA-N
MW3904.00 g/mol
LogP59.56
Rot. Bonds27

About 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine

3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine (PubChem CID 159787240) has the molecular formula C242H520F5N27 and a molecular weight of 3904.00 g/mol. Its IUPAC name is 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
PubChem CID159787240
Molecular FormulaC242H520F5N27
Molecular Weight3904.00 g/mol
Exact Mass3901.14
IUPAC Name3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
SMILESC.C.C.C.C.C.C.C.C.C.CC(C)N1CC2CC2C1.CC(C)N1CC2CCC2C1.CC(C)N1CC2CCCCC2C1.CC(C)N1CCC(C)(C)C1.CC(C)N1CCC(C)(C)CC1.CC(C)N1CCC(C)(F)CC1.CC(C)N1CCC(F)(F)C1.CC(C)N1CCCC(C)(C)C1.CC(C)N1CCCC(C)(F)C1.CC(C)N1CCCC1.CC(C)N1CCCC1(C)C.CC(C)N1CCCCC1.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@@H](F)C1.CC(C)N1CCC[C@@H]1C.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H]1C.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1C[C@H](C)[C@@H](C)C1.CC1CCN(C(C)C)CC1.CC1CCN(C(C)C)CC1
InChIInChI=1S/C11H21N.2C10H21N.2C9H18FN.C9H17N.8C9H19N.C8H16FN.C8H15N.9C8H17N.C7H13F2N.C7H15N.10CH4/c1-9(2)12-7-10-5-3-4-6-11(10)8-12;1-9(2)11-7-5-10(3,4)6-8-11;1-9(2)11-7-5-6-10(3,4)8-11;1-8(2)11-6-4-9(3,10)5-7-11;1-8(2)11-6-4-5-9(3,10)7-11;1-7(2)10-5-8-3-4-9(8)6-10;1-7(2)10-5-8(3)9(4)6-10;1-8(2)10-6-5-9(3,4)7-10;1-8(2)10-7-5-6-9(10,3)4;2*1-8(2)10-6-4-9(3)5-7-10;3*1-8(2)10-6-4-5-9(3)7-10;1-7(2)10-5-3-4-8(9)6-10;1-6(2)9-4-7-3-8(7)5-9;6*1-7(2)9-5-4-8(3)6-9;2*1-7(2)9-6-4-5-8(9)3;1-8(2)9-6-4-3-5-7-9;1-6(2)10-4-3-7(8,9)5-10;1-7(2)8-5-3-4-6-8;;;;;;;;;;/h9-11H,3-8H2,1-2H3;2*9H,5-8H2,1-4H3;2*8H,4-7H2,1-3H3;7-9H,3-6H2,1-2H3;7-9H,5-6H2,1-4H3;2*8H,5-7H2,1-4H3;5*8-9H,4-7H2,1-3H3;7-8H,3-6H2,1-2H3;6-8H,3-5H2,1-2H3;8*7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3;6H,3-5H2,1-2H3;7H,3-6H2,1-2H3;10*1H4/t;;;;;;8-,9-;;;;;3*9-;8-;;8*8-;;;;;;;;;;;;;/m......0....1001.11100010............./s1
InChIKeyNICJPVPOCWVDQD-GSZYZGARSA-N
XLogP59.56
TPSA87.48 Ų
H-Bond Donors
H-Bond Acceptors27
Rotatable Bonds27
Heavy Atoms274
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003904.00
LogP ≤ 559.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1027

Analyze 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine with MolForge

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Launch Full Analysis

Related Compounds

3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 157154784
3,3-Dimethylbutylcyclobutane;3,3-dimethylbutylcyclohexane;3-(3,3-dimethylbutyl)-6,6-difluoro-3-azabicyclo[3.1.0]hexane;1-(3,3-dimethylbutyl)-3,3-difluoroazetidine;1-(3,3-dimethylbutyl)-4,4-difluoro-2,2-dimethylpyrrolidine;1-(3,3-dimethylbutyl)-5,5-difluoro-2-methylpiperidine;1-(3,3-dimethylbutyl)-4,4-difluoro-2-methylpyrrolidine;1-(3,3-dimethylbutyl)-3,3-difluoropiperidine;1-(3,3-dimethylbutyl)-3,4-difluoropiperidine;1-(3,3-dimethylbutyl)-3,5-difluoropiperidine;1-(3,3-dimethylbutyl)-4,4-difluoropiperidine;1-(3,3-dimethylbutyl)-3,3-difluoropyrrolidine;1-(3,3-dimethylbutyl)-3,4-difluoropyrrolidine;1-(3,3-dimethylbutyl)-3,3-dimethylazetidine;1-(3,3-dimethylbutyl)-3-fluoro-3-methylpiperidine;1-(3,3-dimethylbutyl)-3-fluoro-3-methylpyrrolidine;1-(3,3-dimethylbutyl)-3-fluoropyrrolidine;1-(3,3-dimethylbutyl)-3-(trifluoromethyl)azetidine
CID 157392802
3,3-difluoro-1-propan-2-ylpyrrolidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpyrrolidine;(3R)-3-fluoro-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpiperidine;(3S)-3-methyl-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;(2S)-2-methyl-1-propan-2-ylpyrrolidine;bis((3R)-3-methyl-1-propan-2-ylpyrrolidine);bis((3S)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 157467214
3,3-dimethyl-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;4-methyl-1-propan-2-ylpiperidine;bis((2R)-2-methyl-1-propan-2-ylpyrrolidine);tetrakis((3R)-3-methyl-1-propan-2-ylpyrrolidine);bis((3S)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine
CID 159355195
2,2-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2S)-2-ethyl-1-propan-2-ylpyrrolidine;(2R)-2-ethyl-1-propan-2-ylpyrrolidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpyrrolidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylpyrrolidine;(3S)-3-(fluoromethyl)-1-propan-2-ylpiperidine;(3R)-3-(fluoromethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;(2S)-2-methyl-1-propan-2-ylpyrrolidine;2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine
CID 159774105
3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 160472366
3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;4-fluoro-1-propan-2-ylpiperidine;bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis((3R)-3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;1-propan-2-yl-3,3a,4,5,6,6a-hexahydro-2H-cyclopenta[b]pyrrole;1-propan-2-yl-2,3,3a,4,5,6,7,7a-octahydroindole;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;2-propan-2-yl-2-azabicyclo[3.2.0]heptane;7-propan-2-yl-7-azabicyclo[2.2.1]heptane;2-propan-2-yl-2-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;(3R)-1-propan-2-yl-3-(trifluoromethyl)piperidine
CID 160708263
3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;4-fluoro-1-propan-2-ylpiperidine;bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis((3R)-3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylazepane;1-propan-2-ylpiperidine
CID 161070680
CID 161264327
CID 161264327
3,3-Dimethylbutylcyclobutane;3,3-dimethylbutylcyclohexane;3-(3,3-dimethylbutyl)-6,6-difluoro-3-azabicyclo[3.1.0]hexane;1-(3,3-dimethylbutyl)-3,3-difluoroazetidine;1-(3,3-dimethylbutyl)-4,4-difluoro-2,2-dimethylpyrrolidine;1-(3,3-dimethylbutyl)-5,5-difluoro-2-methylpiperidine;1-(3,3-dimethylbutyl)-4,4-difluoro-2-methylpyrrolidine;1-(3,3-dimethylbutyl)-3,3-difluoropiperidine;1-(3,3-dimethylbutyl)-3,4-difluoropiperidine;1-(3,3-dimethylbutyl)-3,5-difluoropiperidine;1-(3,3-dimethylbutyl)-4,4-difluoropiperidine;1-(3,3-dimethylbutyl)-3,3-difluoropyrrolidine;1-(3,3-dimethylbutyl)-3,4-difluoropyrrolidine;1-(3,3-dimethylbutyl)-3,3-dimethylazetidine;1-(3,3-dimethylbutyl)-3-fluoro-3-methylpiperidine;1-(3,3-dimethylbutyl)-3-fluoro-3-methylpyrrolidine;1-(3,3-dimethylbutyl)-3-methylpyrrolidine;1-(3,3-dimethylbutyl)-3-(trifluoromethyl)azetidine
CID 161655987
3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;tris((3S)-3-methyl-1-propan-2-ylpiperidine);tris((3R)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane
CID 158085346
3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;tris((3S)-3-methyl-1-propan-2-ylpiperidine);tris((3R)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);2-propan-2-yl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole;2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine
CID 158455618

Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
The IUPAC name of 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine (CID 159787240) is 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine.
What is the SMILES notation for 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
The canonical SMILES for 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine is C.C.C.C.C.C.C.C.C.C.CC(C)N1CC2CC2C1.CC(C)N1CC2CCC2C1.CC(C)N1CC2CCCCC2C1.CC(C)N1CCC(C)(C)C1.CC(C)N1CCC(C)(C)CC1.CC(C)N1CCC(C)(F)CC1.CC(C)N1CCC(F)(F)C1.CC(C)N1CCCC(C)(C)C1.CC(C)N1CCCC(C)(F)C1.CC(C)N1CCCC1.CC(C)N1CCCC1(C)C.CC(C)N1CCCCC1.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@@H](F)C1.CC(C)N1CCC[C@@H]1C.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H]1C.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H](C)C1.CC(C)N1C[C@H](C)[C@@H](C)C1.CC1CCN(C(C)C)CC1.CC1CCN(C(C)C)CC1.
What is the InChIKey of 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
The InChIKey is NICJPVPOCWVDQD-GSZYZGARSA-N. The full InChI is InChI=1S/C11H21N.2C10H21N.2C9H18FN.C9H17N.8C9H19N.C8H16FN.C8H15N.9C8H17N.C7H13F2N.C7H15N.10CH4/c1-9(2)12-7-10-5-3-4-6-11(10)8-12;1-9(2)11-7-5-10(3,4)6-8-11;1-9(2)11-7-5-6-10(3,4)8-11;1-8(2)11-6-4-9(3,10)5-7-11;1-8(2)11-6-4-5-9(3,10)7-11;1-7(2)10-5-8-3-4-9(8)6-10;1-7(2)10-5-8(3)9(4)6-10;1-8(2)10-6-5-9(3,4)7-10;1-8(2)10-7-5-6-9(10,3)4;2*1-8(2)10-6-4-9(3)5-7-10;3*1-8(2)10-6-4-5-9(3)7-10;1-7(2)10-5-3-4-8(9)6-10;1-6(2)9-4-7-3-8(7)5-9;6*1-7(2)9-5-4-8(3)6-9;2*1-7(2)9-6-4-5-8(9)3;1-8(2)9-6-4-3-5-7-9;1-6(2)10-4-3-7(8,9)5-10;1-7(2)8-5-3-4-6-8;;;;;;;;;;/h9-11H,3-8H2,1-2H3;2*9H,5-8H2,1-4H3;2*8H,4-7H2,1-3H3;7-9H,3-6H2,1-2H3;7-9H,5-6H2,1-4H3;2*8H,5-7H2,1-4H3;5*8-9H,4-7H2,1-3H3;7-8H,3-6H2,1-2H3;6-8H,3-5H2,1-2H3;8*7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3;6H,3-5H2,1-2H3;7H,3-6H2,1-2H3;10*1H4/t;;;;;;8-,9-;;;;;3*9-;8-;;8*8-;;;;;;;;;;;;;/m......0....1001.11100010............./s1.
What are the key properties of 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine has a molecular weight of 3904.00 g/mol, XLogP of 59.56, 27 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;methane;bis((3S)-3-methyl-1-propan-2-ylpiperidine);(3R)-3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);(2S)-2-methyl-1-propan-2-ylpyrrolidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;tris((3S)-3-methyl-1-propan-2-ylpyrrolidine);tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);2-propan-2-yl-1,3,3a,4,5,6,7,7a-octahydroisoindole;3-propan-2-yl-3-azabicyclo[3.2.0]heptane;3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine is sourced from PubChem (CID 159787240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).