3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine

C174H363F9N24 — CID 161351235

IUPAC3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine
SMILESCC(C)N1CC(C(F)F)C1.CC(C)N1CC(C)(C)C1.CC(C)N1CC(F)(F)C1.CC(C)N1CC(F)C1.CC(C)N1CCC1.CC(C)N1CCCC1.CC(C)N1CCC[C@H]1C.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H]1C.CC(C)N1CC[C@@H]1C.CC(C)N1CC[C@@H]1C.CC(C)N1CC[C@@H]1CF.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H]1C.CC(C)N1CC[C@H]1C.CC(C)N1CC[C@H]1C.CC(C)N1CC[C@H]1CF.CC(F)[C@@H]1CCN1C(C)C.CC(F)[C@H]1CCN1C(C)C.CC1CN(C(C)C)C1.CC1CN(C(C)C)C1.CCC1CN(C(C)C)C1.CC[C@@H]1CCN1C(C)C.CC[C@H]1CCN1C(C)C
InChIInChI=1S/2C8H16FN.7C8H17N.C7H13F2N.2C7H14FN.9C7H15N.C6H11F2N.C6H12FN.C6H13N/c2*1-6(2)10-5-4-8(10)7(3)9;1-7(2)9-5-8(3,4)6-9;2*1-7(2)9-5-4-8(3)6-9;1-7(2)9-6-4-5-8(9)3;1-4-8-5-9(6-8)7(2)3;2*1-4-8-5-6-9(8)7(2)3;1-5(2)10-3-6(4-10)7(8)9;2*1-6(2)9-4-3-7(9)5-8;2*1-6(2)8-4-7(3)5-8;6*1-6(2)8-5-4-7(8)3;1-7(2)8-5-3-4-6-8;1-5(2)9-3-6(7,8)4-9;1-5(2)8-3-6(7)4-8;1-6(2)7-4-3-5-7/h2*6-8H,4-5H2,1-3H3;7H,5-6H2,1-4H3;6*7-8H,4-6H2,1-3H3;5-7H,3-4H2,1-2H3;2*6-7H,3-5H2,1-2H3;8*6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;5H,3-4H2,1-2H3;5-6H,3-4H2,1-2H3;6H,3-5H2,1-2H3/t2*7?,8-;;3*8-;;2*8-;;2*7-;;;6*7-;;;;/m10.101.10.10..111000..../s1
InChIKeyVNYKWYBWOIZYNM-LAOAPOEMSA-N
MW2962.97 g/mol
LogP37.32
Rot. Bonds32

About 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine

3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine (PubChem CID 161351235) has the molecular formula C174H363F9N24 and a molecular weight of 2962.97 g/mol. Its IUPAC name is 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine
PubChem CID161351235
Molecular FormulaC174H363F9N24
Molecular Weight2962.97 g/mol
Exact Mass2960.90
IUPAC Name3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine
SMILESCC(C)N1CC(C(F)F)C1.CC(C)N1CC(C)(C)C1.CC(C)N1CC(F)(F)C1.CC(C)N1CC(F)C1.CC(C)N1CCC1.CC(C)N1CCCC1.CC(C)N1CCC[C@H]1C.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H]1C.CC(C)N1CC[C@@H]1C.CC(C)N1CC[C@@H]1C.CC(C)N1CC[C@@H]1CF.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H]1C.CC(C)N1CC[C@H]1C.CC(C)N1CC[C@H]1C.CC(C)N1CC[C@H]1CF.CC(F)[C@@H]1CCN1C(C)C.CC(F)[C@H]1CCN1C(C)C.CC1CN(C(C)C)C1.CC1CN(C(C)C)C1.CCC1CN(C(C)C)C1.CC[C@@H]1CCN1C(C)C.CC[C@H]1CCN1C(C)C
InChIInChI=1S/2C8H16FN.7C8H17N.C7H13F2N.2C7H14FN.9C7H15N.C6H11F2N.C6H12FN.C6H13N/c2*1-6(2)10-5-4-8(10)7(3)9;1-7(2)9-5-8(3,4)6-9;2*1-7(2)9-5-4-8(3)6-9;1-7(2)9-6-4-5-8(9)3;1-4-8-5-9(6-8)7(2)3;2*1-4-8-5-6-9(8)7(2)3;1-5(2)10-3-6(4-10)7(8)9;2*1-6(2)9-4-3-7(9)5-8;2*1-6(2)8-4-7(3)5-8;6*1-6(2)8-5-4-7(8)3;1-7(2)8-5-3-4-6-8;1-5(2)9-3-6(7,8)4-9;1-5(2)8-3-6(7)4-8;1-6(2)7-4-3-5-7/h2*6-8H,4-5H2,1-3H3;7H,5-6H2,1-4H3;6*7-8H,4-6H2,1-3H3;5-7H,3-4H2,1-2H3;2*6-7H,3-5H2,1-2H3;8*6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;5H,3-4H2,1-2H3;5-6H,3-4H2,1-2H3;6H,3-5H2,1-2H3/t2*7?,8-;;3*8-;;2*8-;;2*7-;;;6*7-;;;;/m10.101.10.10..111000..../s1
InChIKeyVNYKWYBWOIZYNM-LAOAPOEMSA-N
XLogP37.32
TPSA77.76 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds32
Heavy Atoms207
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002962.97
LogP ≤ 537.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine with MolForge

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Related Compounds

3,3-difluoro-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;1-propan-2-ylazetidine
CID 159521327
2,2-dimethyl-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S,4S)-3,4-dimethyl-1-propan-2-ylpyrrolidine;(3S,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;(3R,4R)-3,4-dimethyl-1-propan-2-ylpyrrolidine;(3R)-1,3-di(propan-2-yl)pyrrolidine;(3S)-1,3-di(propan-2-yl)pyrrolidine;ethane;(3R)-3-ethyl-1-propan-2-ylpyrrolidine;(3S)-3-ethyl-1-propan-2-ylpyrrolidine;3-fluoro-3-methyl-1-propan-2-ylpyrrolidine;(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-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;prop-1-en-2-amine
CID 162282673
(2R)-2-ethyl-1,4-di(propan-2-yl)-1,4-diazepane
CID 153291285
3-(difluoromethyl)-1-propan-2-ylpiperidine;(3S)-3-(difluoromethyl)-1-propan-2-ylpiperidine;(3R)-3-(difluoromethyl)-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;(3S)-5,5-dimethyl-1-propan-2-ylpiperidin-3-ol;5,5-dimethyl-1-propan-2-ylpiperidin-3-ol;3-fluoro-3-methyl-1-propan-2-ylpiperidine;(3R)-3-fluoro-3-methyl-1-propan-2-ylpiperidine;(3S)-3-fluoro-3-methyl-1-propan-2-ylpiperidine;(3S,4R)-3-fluoro-4-methyl-1-propan-2-ylpiperidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;(3R)-3-fluoro-1-propan-2-ylpiperidine;4-fluoro-1-propan-2-ylpiperidine;(3S,4S)-3-fluoro-1-propan-2-ylpiperidin-4-ol;(2S)-2-methyl-1-propan-2-ylpiperidine;(3R)-3-methyl-1-propan-2-ylpiperidine;3-methyl-1-propan-2-ylpiperidin-3-ol;molecular hydrogen;1-propan-2-ylpiperidine;(3R)-1-propan-2-ylpiperidin-3-ol;(3S)-1-propan-2-ylpiperidin-3-ol;3,3,5,5-tetramethyl-1-propan-2-ylpiperidine
CID 158897373
2-methyl-1-propan-2-ylazetidine;3-methyl-1-propan-2-ylazetidine;2-methyl-1-propan-2-ylaziridine
CID 159786270
3,5-dimethyl-1-propan-2-ylpiperidine;1,3-di(propan-2-yl)piperidine;bis(4-ethyl-1-propan-2-ylpiperidine);3-ethyl-1-propan-2-ylpyrrolidine;methane;3-methyl-1-propan-2-ylpiperidine;bis(4-methyl-1-propan-2-ylpiperidine);3-(2-methylpropyl)-1-propan-2-ylpiperidine;1-propan-2-ylazepane;1-propan-2-ylazetidine;bis(1-propan-2-ylpiperidine);1-propan-2-yl-4-propylpiperidine;1-propan-2-ylpyrrolidine
CID 159988029
bis(1,4-di(propan-2-yl)azepane);bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);1,4-di(propan-2-yl)piperazine;bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)
CID 164980756
ethane;3-methyl-1-propan-2-ylpyrrolidine
CID 156888189
6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-difluoro-1-propan-2-ylazetidine;4,4-difluoro-1-propan-2-ylpiperidine;2,2-dimethyl-1-propan-2-ylpyrrolidine;(2S)-2-methyl-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpyrrolidine;bis((2S)-2-methyl-1-propan-2-ylpyrrolidine);3-propan-2-yl-3-azabicyclo[3.1.0]hexane;1-propan-2-yl-3-(trifluoromethyl)azetidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine
CID 161374833
1,6-di(propan-2-yl)-3,4,4a,5,7,7a-hexahydro-2H-pyrrolo[3,4-b]pyridine;2,5-di(propan-2-yl)-3,3a,4,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridine;1,4-di(propan-2-yl)piperazine;1,3-di(propan-2-yl)piperidine;1,4-di(propan-2-yl)piperidine;1,3-di(propan-2-yl)pyrrolidine;2-methyl-1,4-di(propan-2-yl)piperazine;3-(2-methylpropyl)-1-propan-2-ylpiperidine;2-(2-methylpropyl)-1-propan-2-ylpyrrolidine;3-(2-methylpropyl)-1-propan-2-ylpyrrolidine
CID 159641961
(2S)-2-methyl-1,4-di(propan-2-yl)-1,4-diazepane
CID 153291233
2-ethyl-1-propan-2-ylazetidine;propane
CID 163256433

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine?
The IUPAC name of 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine (CID 161351235) is 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine.
What is the SMILES notation for 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine?
The canonical SMILES for 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine is CC(C)N1CC(C(F)F)C1.CC(C)N1CC(C)(C)C1.CC(C)N1CC(F)(F)C1.CC(C)N1CC(F)C1.CC(C)N1CCC1.CC(C)N1CCCC1.CC(C)N1CCC[C@H]1C.CC(C)N1CC[C@@H](C)C1.CC(C)N1CC[C@@H]1C.CC(C)N1CC[C@@H]1C.CC(C)N1CC[C@@H]1C.CC(C)N1CC[C@@H]1CF.CC(C)N1CC[C@H](C)C1.CC(C)N1CC[C@H]1C.CC(C)N1CC[C@H]1C.CC(C)N1CC[C@H]1C.CC(C)N1CC[C@H]1CF.CC(F)[C@@H]1CCN1C(C)C.CC(F)[C@H]1CCN1C(C)C.CC1CN(C(C)C)C1.CC1CN(C(C)C)C1.CCC1CN(C(C)C)C1.CC[C@@H]1CCN1C(C)C.CC[C@H]1CCN1C(C)C.
What is the InChIKey of 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine?
The InChIKey is VNYKWYBWOIZYNM-LAOAPOEMSA-N. The full InChI is InChI=1S/2C8H16FN.7C8H17N.C7H13F2N.2C7H14FN.9C7H15N.C6H11F2N.C6H12FN.C6H13N/c2*1-6(2)10-5-4-8(10)7(3)9;1-7(2)9-5-8(3,4)6-9;2*1-7(2)9-5-4-8(3)6-9;1-7(2)9-6-4-5-8(9)3;1-4-8-5-9(6-8)7(2)3;2*1-4-8-5-6-9(8)7(2)3;1-5(2)10-3-6(4-10)7(8)9;2*1-6(2)9-4-3-7(9)5-8;2*1-6(2)8-4-7(3)5-8;6*1-6(2)8-5-4-7(8)3;1-7(2)8-5-3-4-6-8;1-5(2)9-3-6(7,8)4-9;1-5(2)8-3-6(7)4-8;1-6(2)7-4-3-5-7/h2*6-8H,4-5H2,1-3H3;7H,5-6H2,1-4H3;6*7-8H,4-6H2,1-3H3;5-7H,3-4H2,1-2H3;2*6-7H,3-5H2,1-2H3;8*6-7H,4-5H2,1-3H3;7H,3-6H2,1-2H3;5H,3-4H2,1-2H3;5-6H,3-4H2,1-2H3;6H,3-5H2,1-2H3/t2*7?,8-;;3*8-;;2*8-;;2*7-;;;6*7-;;;;/m10.101.10.10..111000..../s1.
What are the key properties of 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine?
3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine has a molecular weight of 2962.97 g/mol, XLogP of 37.32, 32 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethyl)-1-propan-2-ylazetidine;3,3-difluoro-1-propan-2-ylazetidine;3,3-dimethyl-1-propan-2-ylazetidine;(2S)-2-ethyl-1-propan-2-ylazetidine;(2R)-2-ethyl-1-propan-2-ylazetidine;3-ethyl-1-propan-2-ylazetidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2R)-2-(1-fluoroethyl)-1-propan-2-ylazetidine;(2S)-2-(fluoromethyl)-1-propan-2-ylazetidine;(2R)-2-(fluoromethyl)-1-propan-2-ylazetidine;3-fluoro-1-propan-2-ylazetidine;tris((2R)-2-methyl-1-propan-2-ylazetidine);tris((2S)-2-methyl-1-propan-2-ylazetidine);bis(3-methyl-1-propan-2-ylazetidine);(2R)-2-methyl-1-propan-2-ylpyrrolidine;(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylazetidine;1-propan-2-ylpyrrolidine is sourced from PubChem (CID 161351235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).