3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine

C223H466F5N25 — CID 160553978

IUPAC3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine
SMILESCC(C)N1CCC(C)(C)CC1.CC(C)N1CCC(C)(F)CC1.CC(C)N1CCCC(C)(C)C1.CC(C)N1CCCC(C)(F)C1.CC(C)N1CCCCC1.CC(C)N1CCCC[C@H]1C.CC(C)N1CCCC[C@H]1F.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H]1C.CC(C)N1CCC[C@H]1C.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(F)[C@@H]1CCCCN1C(C)C.CC(F)[C@@H]1CCCN(C(C)C)C1.CC1CCN(C(C)C)CC1.CC1CCN(C(C)C)CC1.CCC1CCN(C(C)C)CC1.CC[C@@H]1CCCCN1C(C)C.CC[C@@H]1CCCN(C(C)C)C1
InChIInChI=1S/2C10H20FN.5C10H21N.2C9H18FN.7C9H19N.C8H16FN.8C8H17N/c1-8(2)12-6-4-5-10(7-12)9(3)11;1-8(2)12-7-5-4-6-10(12)9(3)11;1-9(2)11-7-5-10(3,4)6-8-11;1-9(2)11-7-5-6-10(3,4)8-11;1-4-10-5-7-11(8-6-10)9(2)3;1-4-10-6-5-7-11(8-10)9(2)3;1-4-10-7-5-6-8-11(10)9(2)3;1-8(2)11-6-4-9(3,10)5-7-11;1-8(2)11-6-4-5-9(3,10)7-11;2*1-8(2)10-6-4-9(3)5-7-10;4*1-8(2)10-6-4-5-9(3)7-10;1-8(2)10-7-5-4-6-9(10)3;1-7(2)10-6-4-3-5-8(10)9;4*1-7(2)9-5-4-8(3)6-9;3*1-7(2)9-6-4-5-8(9)3;1-8(2)9-6-4-3-5-7-9/h2*8-10H,4-7H2,1-3H3;2*9H,5-8H2,1-4H3;3*9-10H,4-8H2,1-3H3;2*8H,4-7H2,1-3H3;7*8-9H,4-7H2,1-3H3;7-8H,3-6H2,1-2H3;7*7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3/t2*9?,10-;;;;2*10-;;;;;5*9-;8*8-;/m10...11....1100101110111./s1
InChIKeyQYLAOOZMVPABQG-HHWJGFRXSA-N
MW3593.35 g/mol
LogP53.91
Rot. Bonds30

About 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine

3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine (PubChem CID 160553978) has the molecular formula C223H466F5N25 and a molecular weight of 3593.35 g/mol. Its IUPAC name is 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine.

Molecular Properties

Compound Name3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine
PubChem CID160553978
Molecular FormulaC223H466F5N25
Molecular Weight3593.35 g/mol
Exact Mass3590.72
IUPAC Name3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine
SMILESCC(C)N1CCC(C)(C)CC1.CC(C)N1CCC(C)(F)CC1.CC(C)N1CCCC(C)(C)C1.CC(C)N1CCCC(C)(F)C1.CC(C)N1CCCCC1.CC(C)N1CCCC[C@H]1C.CC(C)N1CCCC[C@H]1F.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H]1C.CC(C)N1CCC[C@H]1C.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(F)[C@@H]1CCCCN1C(C)C.CC(F)[C@@H]1CCCN(C(C)C)C1.CC1CCN(C(C)C)CC1.CC1CCN(C(C)C)CC1.CCC1CCN(C(C)C)CC1.CC[C@@H]1CCCCN1C(C)C.CC[C@@H]1CCCN(C(C)C)C1
InChIInChI=1S/2C10H20FN.5C10H21N.2C9H18FN.7C9H19N.C8H16FN.8C8H17N/c1-8(2)12-6-4-5-10(7-12)9(3)11;1-8(2)12-7-5-4-6-10(12)9(3)11;1-9(2)11-7-5-10(3,4)6-8-11;1-9(2)11-7-5-6-10(3,4)8-11;1-4-10-5-7-11(8-6-10)9(2)3;1-4-10-6-5-7-11(8-10)9(2)3;1-4-10-7-5-6-8-11(10)9(2)3;1-8(2)11-6-4-9(3,10)5-7-11;1-8(2)11-6-4-5-9(3,10)7-11;2*1-8(2)10-6-4-9(3)5-7-10;4*1-8(2)10-6-4-5-9(3)7-10;1-8(2)10-7-5-4-6-9(10)3;1-7(2)10-6-4-3-5-8(10)9;4*1-7(2)9-5-4-8(3)6-9;3*1-7(2)9-6-4-5-8(9)3;1-8(2)9-6-4-3-5-7-9/h2*8-10H,4-7H2,1-3H3;2*9H,5-8H2,1-4H3;3*9-10H,4-8H2,1-3H3;2*8H,4-7H2,1-3H3;7*8-9H,4-7H2,1-3H3;7-8H,3-6H2,1-2H3;7*7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3/t2*9?,10-;;;;2*10-;;;;;5*9-;8*8-;/m10...11....1100101110111./s1
InChIKeyQYLAOOZMVPABQG-HHWJGFRXSA-N
XLogP53.91
TPSA81.00 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds30
Heavy Atoms253
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003593.35
LogP ≤ 553.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine with MolForge

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Launch Full Analysis

Related Compounds

1-Tert-butyl-4,4-difluoro-2,2-dimethylpyrrolidine;1-tert-butyl-4,4-difluoropiperidine;1-tert-butyl-2,4-dimethylpyrrolidine;1-tert-butyl-4-fluoro-2,4-dimethylpyrrolidine;1-tert-butyl-3-fluoro-3-methylazetidine;1-tert-butyl-3-fluoro-3-methylpyrrolidine;bis(1-tert-butyl-2-methylpiperidine);bis(1-tert-butyl-4-methylpiperidine);1-tert-butyl-2-methylpyrrolidine;1-tert-butyl-3-methylpyrrolidine
CID 157767398
6,6-difluoro-3-propan-2-yl-3-azabicyclo[3.1.0]hexane;3,3-difluoro-1-propan-2-ylpyrrolidine;3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(3R)-3-(fluoromethyl)-1-propan-2-ylpyrrolidine;bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis((3R)-3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis((2R)-2-methyl-1-propan-2-ylpyrrolidine);bis((3R)-3-methyl-1-propan-2-ylpyrrolidine);bis((3S)-3-methyl-1-propan-2-ylpyrrolidine);(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(3R)-1-propan-2-yl-3-(trifluoromethyl)pyrrolidine
CID 157835252
2,2-Difluoro-1-methylpiperidine;3,3-difluoro-1-methylpiperidine;4,4-difluoro-1-methylpiperidine;3,3-difluoro-1-methylpyrrolidine;2-fluoro-1-methylpiperidine;3-fluoro-1-methylpiperidine;4-fluoro-1-methylpiperidine;3,3,4,4,5,5-hexafluoro-1-methylpiperidine;1-methylpiperidine;1-methyl-3-(2,2,2-trifluoroethyl)pyrrolidine;1-methyl-3-(trifluoromethyl)pyrrolidine;3,3,4,4-tetrafluoro-1-methylpyrrolidine
CID 157868331
4-[(2R)-2-(difluoromethyl)pyrrolidin-1-yl]-1-methylpiperidine;4-(3,3-difluoropyrrolidin-1-yl)-1-methylpiperidine;4-[(2R)-2-(fluoromethyl)pyrrolidin-1-yl]-1-methylpiperidine;4-[(3R)-3-fluoropyrrolidin-1-yl]-1-methylpiperidine;4-[(3S)-3-fluoropyrrolidin-1-yl]-1-methylpiperidine;3-(1-methylpiperidin-4-yl)-3-azabicyclo[3.1.0]hexane;1-methyl-4-[(2R)-2-(trifluoromethyl)pyrrolidin-1-yl]piperidine;1-methyl-4-[(2S)-2-(trifluoromethyl)pyrrolidin-1-yl]piperidine
CID 160292066
Bis(3,3-difluoro-1,4-di(propan-2-yl)pyrrolidine);tetrakis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);hexakis(1,3-di(propan-2-yl)pyrrolidine);ethane;fluoromethane;bis(4-methyl-1,2-di(propan-2-yl)piperazine)
CID 164985381
3,3-Difluoro-4-[4-(2-methylpropyl)piperidin-1-yl]-1-propan-2-ylpiperidine;bis(3,3-difluoro-4-[3-(2-methylpropyl)pyrrolidin-1-yl]-1-propan-2-ylpiperidine);bis(4-[3,3-difluoro-4-(2-methylpropyl)pyrrolidin-1-yl]-1-propan-2-ylpiperidine);4-(2-methylpropyl)-1-(1-propan-2-ylazetidin-3-yl)piperidine;bis(4-[3-(2-methylpropyl)pyrrolidin-1-yl]-1-propan-2-ylpiperidine)
CID 165012816
Bis(3,3-difluoro-4-[4-(2-methylpropyl)piperidin-1-yl]-1-propan-2-ylpiperidine);bis(4-[3,3-difluoro-4-(2-methylpropyl)pyrrolidin-1-yl]-1-propan-2-ylpiperidine);bis(4-[3-(2-methylpropyl)pyrrolidin-1-yl]-1-propan-2-ylpiperidine)
CID 165024952
Bis(3,3-difluoro-1,4-di(propan-2-yl)pyrrolidine);bis(1,4-di(propan-2-yl)piperazine);tetrakis(1,2-di(propan-2-yl)piperidine);tetrakis(1,3-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;fluoromethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)
CID 167581014
Bis(3,3-difluoro-1,4-di(propan-2-yl)pyrrolidine);tetrakis(1,2-di(propan-2-yl)piperidine);tris(1,3-di(propan-2-yl)piperidine);pentakis(1,3-di(propan-2-yl)pyrrolidine);ethane;fluoromethane;1-methyl-3,4-di(propan-2-yl)-1,3-diazinane;4-methyl-1,2-di(propan-2-yl)piperazine
CID 167602523
3,3-Difluoro-4-[4-(2-methylpropyl)piperidin-1-yl]-1-propan-2-ylpiperidine;bis(3,3-difluoro-4-[3-(2-methylpropyl)pyrrolidin-1-yl]-1-propan-2-ylpiperidine);bis(4-[3,3-difluoro-4-(2-methylpropyl)pyrrolidin-1-yl]-1-propan-2-ylpiperidine);bis(4-[3-(2-methylpropyl)pyrrolidin-1-yl]-1-propan-2-ylpiperidine)
CID 167609710
Bis(3,3-difluoro-1,4-di(propan-2-yl)pyrrolidine);tetrakis(1,2-di(propan-2-yl)piperidine);tetrakis(1,3-di(propan-2-yl)piperidine);tetrakis(1,3-di(propan-2-yl)pyrrolidine);ethane;fluoromethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)
CID 168417152
(1R,3R,5R)-2-tert-butyl-3,5-dimethyl-2-azabicyclo[3.1.0]hexane;(1R,5S)-2,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;2,3-ditert-butyl-3-azabicyclo[3.1.0]hexane;(1S,5R)-3,4-ditert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane;2,3-ditert-butyl-5-methyl-2-azabicyclo[3.1.0]hexane;3,4-ditert-butyl-1-methyl-3-azabicyclo[3.1.0]hexane
CID 157214386

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine?
The IUPAC name of 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine (CID 160553978) is 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine.
What is the SMILES notation for 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine?
The canonical SMILES for 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine is CC(C)N1CCC(C)(C)CC1.CC(C)N1CCC(C)(F)CC1.CC(C)N1CCCC(C)(C)C1.CC(C)N1CCCC(C)(F)C1.CC(C)N1CCCCC1.CC(C)N1CCCC[C@H]1C.CC(C)N1CCCC[C@H]1F.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H](C)C1.CC(C)N1CCC[C@H]1C.CC(C)N1CCC[C@H]1C.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(F)[C@@H]1CCCCN1C(C)C.CC(F)[C@@H]1CCCN(C(C)C)C1.CC1CCN(C(C)C)CC1.CC1CCN(C(C)C)CC1.CCC1CCN(C(C)C)CC1.CC[C@@H]1CCCCN1C(C)C.CC[C@@H]1CCCN(C(C)C)C1.
What is the InChIKey of 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine?
The InChIKey is QYLAOOZMVPABQG-HHWJGFRXSA-N. The full InChI is InChI=1S/2C10H20FN.5C10H21N.2C9H18FN.7C9H19N.C8H16FN.8C8H17N/c1-8(2)12-6-4-5-10(7-12)9(3)11;1-8(2)12-7-5-4-6-10(12)9(3)11;1-9(2)11-7-5-10(3,4)6-8-11;1-9(2)11-7-5-6-10(3,4)8-11;1-4-10-5-7-11(8-6-10)9(2)3;1-4-10-6-5-7-11(8-10)9(2)3;1-4-10-7-5-6-8-11(10)9(2)3;1-8(2)11-6-4-9(3,10)5-7-11;1-8(2)11-6-4-5-9(3,10)7-11;2*1-8(2)10-6-4-9(3)5-7-10;4*1-8(2)10-6-4-5-9(3)7-10;1-8(2)10-7-5-4-6-9(10)3;1-7(2)10-6-4-3-5-8(10)9;4*1-7(2)9-5-4-8(3)6-9;3*1-7(2)9-6-4-5-8(9)3;1-8(2)9-6-4-3-5-7-9/h2*8-10H,4-7H2,1-3H3;2*9H,5-8H2,1-4H3;3*9-10H,4-8H2,1-3H3;2*8H,4-7H2,1-3H3;7*8-9H,4-7H2,1-3H3;7-8H,3-6H2,1-2H3;7*7-8H,4-6H2,1-3H3;8H,3-7H2,1-2H3/t2*9?,10-;;;;2*10-;;;;;5*9-;8*8-;/m10...11....1100101110111./s1.
What are the key properties of 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine?
3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine has a molecular weight of 3593.35 g/mol, XLogP of 53.91, 30 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-propan-2-ylpiperidine;4,4-dimethyl-1-propan-2-ylpiperidine;(2R)-2-ethyl-1-propan-2-ylpiperidine;(3R)-3-ethyl-1-propan-2-ylpiperidine;4-ethyl-1-propan-2-ylpiperidine;(2S)-2-(1-fluoroethyl)-1-propan-2-ylpiperidine;(3R)-3-(1-fluoroethyl)-1-propan-2-ylpiperidine;3-fluoro-3-methyl-1-propan-2-ylpiperidine;4-fluoro-4-methyl-1-propan-2-ylpiperidine;(2R)-2-fluoro-1-propan-2-ylpiperidine;(2R)-2-methyl-1-propan-2-ylpiperidine;bis((3R)-3-methyl-1-propan-2-ylpiperidine);bis((3S)-3-methyl-1-propan-2-ylpiperidine);bis(4-methyl-1-propan-2-ylpiperidine);tris((2R)-2-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;tris((3R)-3-methyl-1-propan-2-ylpyrrolidine);1-propan-2-ylpiperidine is sourced from PubChem (CID 160553978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).