4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine

C139H298F2N24O4 — CID 159599369

IUPAC4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
SMILESCC(C)CC1CCN(C)CC1.CC(C)CN1CCCC1.CC(C)CN1CCN(C)CC1.CC(C)N(C)C1CCN(C)CC1.CC(C)N1CCC(F)(F)CC1.CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C)CC1.CC(C)N1CCNCC1.CC(C)N1CCOCC1.CC(C)N1C[C@@H]2C[C@H]1CN2C.CC(C)OCCN1CCCC1.CC(C)OCCN1CCCCC1.CC(C)OCCN1CCN(C)CC1.CCN1CCN(C(C)C)CC1
InChIInChI=1S/C10H22N2O.2C10H22N2.C10H21NO.C10H21N.C9H18N2.2C9H20N2.C9H19NO.C8H15F2N.C8H18N2.2C8H17N.C7H16N2.C7H15NO.C7H15N/c1-10(2)13-9-8-12-6-4-11(3)5-7-12;1-9(2)12(4)10-5-7-11(3)8-6-10;1-9(2)11-5-7-12(8-6-11)10(3)4;1-10(2)12-9-8-11-6-4-3-5-7-11;1-9(2)8-10-4-6-11(3)7-5-10;1-7(2)11-6-8-4-9(11)5-10(8)3;1-9(2)8-11-6-4-10(3)5-7-11;1-4-10-5-7-11(8-6-10)9(2)3;1-9(2)11-8-7-10-5-3-4-6-10;1-7(2)11-5-3-8(9,10)4-6-11;1-8(2)10-6-4-9(3)5-7-10;1-8(2)7-9-5-3-4-6-9;1-8(2)9-6-4-3-5-7-9;1-7(2)9-5-3-8-4-6-9;1-7(2)8-3-5-9-6-4-8;1-7(2)8-5-3-4-6-8/h10H,4-9H2,1-3H3;2*9-10H,5-8H2,1-4H3;10H,3-9H2,1-2H3;9-10H,4-8H2,1-3H3;7-9H,4-6H2,1-3H3;2*9H,4-8H2,1-3H3;9H,3-8H2,1-2H3;7H,3-6H2,1-2H3;8H,4-7H2,1-3H3;2*8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3/t;;;;;8-,9-;;;;;;;;;;/m.....0........../s1
InChIKeyMLGRGCYSQDMPAU-AUWUFRKESA-N
MW2408.07 g/mol
LogP20.89
Rot. Bonds31

About 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine

4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine (PubChem CID 159599369) has the molecular formula C139H298F2N24O4 and a molecular weight of 2408.07 g/mol. Its IUPAC name is 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine.

Molecular Properties

Compound Name4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
PubChem CID159599369
Molecular FormulaC139H298F2N24O4
Molecular Weight2408.07 g/mol
Exact Mass2406.38
IUPAC Name4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
SMILESCC(C)CC1CCN(C)CC1.CC(C)CN1CCCC1.CC(C)CN1CCN(C)CC1.CC(C)N(C)C1CCN(C)CC1.CC(C)N1CCC(F)(F)CC1.CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C)CC1.CC(C)N1CCNCC1.CC(C)N1CCOCC1.CC(C)N1C[C@@H]2C[C@H]1CN2C.CC(C)OCCN1CCCC1.CC(C)OCCN1CCCCC1.CC(C)OCCN1CCN(C)CC1.CCN1CCN(C(C)C)CC1
InChIInChI=1S/C10H22N2O.2C10H22N2.C10H21NO.C10H21N.C9H18N2.2C9H20N2.C9H19NO.C8H15F2N.C8H18N2.2C8H17N.C7H16N2.C7H15NO.C7H15N/c1-10(2)13-9-8-12-6-4-11(3)5-7-12;1-9(2)12(4)10-5-7-11(3)8-6-10;1-9(2)11-5-7-12(8-6-11)10(3)4;1-10(2)12-9-8-11-6-4-3-5-7-11;1-9(2)8-10-4-6-11(3)7-5-10;1-7(2)11-6-8-4-9(11)5-10(8)3;1-9(2)8-11-6-4-10(3)5-7-11;1-4-10-5-7-11(8-6-10)9(2)3;1-9(2)11-8-7-10-5-3-4-6-10;1-7(2)11-5-3-8(9,10)4-6-11;1-8(2)10-6-4-9(3)5-7-10;1-8(2)7-9-5-3-4-6-9;1-8(2)9-6-4-3-5-7-9;1-7(2)9-5-3-8-4-6-9;1-7(2)8-3-5-9-6-4-8;1-7(2)8-5-3-4-6-8/h10H,4-9H2,1-3H3;2*9-10H,5-8H2,1-4H3;10H,3-9H2,1-2H3;9-10H,4-8H2,1-3H3;7-9H,4-6H2,1-3H3;2*9H,4-8H2,1-3H3;9H,3-8H2,1-2H3;7H,3-6H2,1-2H3;8H,4-7H2,1-3H3;2*8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3/t;;;;;8-,9-;;;;;;;;;;/m.....0........../s1
InChIKeyMLGRGCYSQDMPAU-AUWUFRKESA-N
XLogP20.89
TPSA123.47 Ų
H-Bond Donors1
H-Bond Acceptors28
Rotatable Bonds31
Heavy Atoms169
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002408.07
LogP ≤ 520.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1028

Analyze 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine with MolForge

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

Launch Full Analysis

Related Compounds

6-Tert-butyl-3-azabicyclo[3.1.0]hexane;4-tert-butyl-3-fluoro-3-methylpiperidine;4-tert-butyl-3-fluoro-5-methylpiperidine;4-tert-butyl-4-fluoropiperidine;bis(4-tert-butyl-4-methylpiperidine);2-tert-butylmorpholine;4-tert-butylpiperidine;3-fluoro-3-methyl-4-propan-2-ylpyrrolidine;3-fluoro-3-propan-2-ylpyrrolidine;3-methyl-3-propan-2-ylpyrrolidine;3-methyl-4-propan-2-ylpyrrolidine;3-propan-2-ylpyrrolidine;3-propan-2-yl-3-(trifluoromethyl)pyrrolidine
CID 157119688
6-Tert-butyl-3-azabicyclo[3.1.0]hexane;4-tert-butyl-3,3-difluoropiperidine;4-tert-butyl-3,5-difluoropiperidine;4-tert-butyl-4-fluoropiperidine;bis(4-tert-butyl-4-methylpiperidine);2-tert-butylmorpholine;4-tert-butylpiperidine;3-fluoro-3-methyl-4-propan-2-ylpyrrolidine;3-fluoro-3-propan-2-ylpyrrolidine;3-fluoro-4-propan-2-ylpyrrolidine;methane;3-methyl-3-propan-2-ylpyrrolidine;3-propan-2-ylpyrrolidine;3-propan-2-yl-3-(trifluoromethyl)pyrrolidine
CID 157172424
6-Tert-butyl-3-azabicyclo[3.1.0]hexane;4-tert-butyl-3-fluoro-3-methylpiperidine;4-tert-butyl-3-fluoro-5-methylpiperidine;4-tert-butyl-4-fluoropiperidine;bis(4-tert-butyl-4-methylpiperidine);2-tert-butylmorpholine;4-tert-butylpiperidine;3,3-difluoro-4-propan-2-ylpyrrolidine;3-fluoro-3-propan-2-ylpyrrolidine;methane;3-methyl-3-propan-2-ylpyrrolidine;3-methyl-4-propan-2-ylpyrrolidine;3-propan-2-ylpyrrolidine;3-propan-2-yl-3-(trifluoromethyl)pyrrolidine
CID 157589100
CID 157818371
CID 157818371
4-[(2S)-1-ethylpyrrolidin-2-yl]-1-methylpiperidine;4-[(2S)-1-(2-fluoroethyl)pyrrolidin-2-yl]-1-methylpiperidine;4-[(2S)-1-(2-methoxyethyl)pyrrolidin-2-yl]-1-methylpiperidine;1-methyl-4-(1-methylpyrrolidin-2-yl)piperidine;1-methyl-4-pyrrolidin-2-ylpiperidine;1-methyl-4-[(2S)-1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]piperidine;1-methyl-4-[(2S)-1-(3,3,3-trifluoropropyl)pyrrolidin-2-yl]piperidine
CID 158334799
3,3-difluoro-1-propan-2-ylpiperidine;4,4-difluoro-1-propan-2-ylpiperidine;3,3-dimethyl-1-propan-2-ylpiperidine;bis((3R)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine);(3S)-N,N-dimethyl-1-propan-2-ylpyrrolidin-3-amine;3,3-dimethyl-1-propan-2-ylpyrrolidine;(3S)-3-fluoro-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpiperidine;3-methoxy-1-propan-2-ylpyrrolidine;4-methylmorpholine;1-methyl-4-propan-2-ylpiperazine;bis(3-methyl-1-propan-2-ylpiperidine);4-methyl-1-propan-2-ylpiperidine;bis(3-methyl-1-propan-2-ylpyrrolidine);(3S)-3-methyl-1-propan-2-ylpyrrolidine;(3R)-3-methyl-1-propan-2-ylpyrrolidine;1-propan-2-ylpiperidine;1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;1-propan-2-yl-3-(trifluoromethyl)pyrrolidine;(2S)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine;(2R)-1-propan-2-yl-2-(trifluoromethyl)pyrrolidine
CID 158355162
N-tert-butylcyclopentanamine;N-tert-butyl-N',N'-diethylethane-1,2-diamine;1-tert-butyl-N,N-dimethylpiperidin-4-amine;N-tert-butyl-3-methylpiperidin-4-amine;N-tert-butylpiperidin-3-amine;N-tert-butylpiperidin-4-amine;3,3-difluoropiperidin-4-amine;1-ethyl-3-fluoropiperidin-4-amine;1-ethylpiperidin-3-amine;1-ethylpyrrolidin-3-amine;N-[(4-fluoropiperidin-4-yl)methyl]-2-methylpropan-2-amine;methane;2-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]propan-2-amine;4-methylpiperidin-4-amine;hexakis(2-methylpropane);3-[(2-methylpropan-2-yl)oxy]-1-azabicyclo[2.2.1]heptane;oxan-2-ylmethanamine
CID 158614735
4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperazine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;4-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 158684961
CID 158838479
CID 158838479
6-Tert-butyl-3-azabicyclo[3.1.0]hexane;4-tert-butyl-3,3-difluoropiperidine;4-tert-butyl-4-fluoropiperidine;4-tert-butyl-4-methylpiperidine;2-tert-butylmorpholine;4-tert-butylpiperidine;4-tert-butyl-4-(trifluoromethyl)piperidine;3,5-difluoro-4-propan-2-ylpiperidine;3,3-difluoro-4-propan-2-ylpyrrolidine;3-fluoro-3-propan-2-ylpyrrolidine;3-fluoro-4-propan-2-ylpyrrolidine;3-methyl-3-propan-2-ylpyrrolidine;3-propan-2-ylpyrrolidine;3-propan-2-yl-3-(trifluoromethyl)pyrrolidine
CID 159211090
4,4-difluoro-1-(2-methylpropyl)piperidine;3-fluoro-1-(2-methylpropyl)azetidine;4-fluoro-1-(2-methylpropyl)piperidine;1-methyl-4-propan-2-yloxypiperidine;1-methyl-4-propan-2-ylpiperazine;1-methyl-N-propan-2-ylpiperidin-4-amine;1-methyl-4-propan-2-ylpiperidine;4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrrolidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpyrrolidine
CID 159467287
6-Tert-butyl-3-azabicyclo[3.1.0]hexane;4-tert-butyl-3-fluoro-3-methylpiperidine;4-tert-butyl-3-fluoro-5-methylpiperidine;4-tert-butyl-4-fluoropiperidine;bis(4-tert-butyl-4-methylpiperidine);2-tert-butylmorpholine;4-tert-butylpiperidine;3-fluoro-3-methyl-4-propan-2-ylpyrrolidine;3-fluoro-3-propan-2-ylpyrrolidine;3-fluoro-4-propan-2-ylpyrrolidine;3-methyl-3-propan-2-ylpyrrolidine;3-propan-2-ylpyrrolidine;3-propan-2-yl-3-(trifluoromethyl)pyrrolidine
CID 159504145

Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
The IUPAC name of 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine (CID 159599369) is 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine.
What is the SMILES notation for 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
The canonical SMILES for 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine is CC(C)CC1CCN(C)CC1.CC(C)CN1CCCC1.CC(C)CN1CCN(C)CC1.CC(C)N(C)C1CCN(C)CC1.CC(C)N1CCC(F)(F)CC1.CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCN(C(C)C)CC1.CC(C)N1CCN(C)CC1.CC(C)N1CCNCC1.CC(C)N1CCOCC1.CC(C)N1C[C@@H]2C[C@H]1CN2C.CC(C)OCCN1CCCC1.CC(C)OCCN1CCCCC1.CC(C)OCCN1CCN(C)CC1.CCN1CCN(C(C)C)CC1.
What is the InChIKey of 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
The InChIKey is MLGRGCYSQDMPAU-AUWUFRKESA-N. The full InChI is InChI=1S/C10H22N2O.2C10H22N2.C10H21NO.C10H21N.C9H18N2.2C9H20N2.C9H19NO.C8H15F2N.C8H18N2.2C8H17N.C7H16N2.C7H15NO.C7H15N/c1-10(2)13-9-8-12-6-4-11(3)5-7-12;1-9(2)12(4)10-5-7-11(3)8-6-10;1-9(2)11-5-7-12(8-6-11)10(3)4;1-10(2)12-9-8-11-6-4-3-5-7-11;1-9(2)8-10-4-6-11(3)7-5-10;1-7(2)11-6-8-4-9(11)5-10(8)3;1-9(2)8-11-6-4-10(3)5-7-11;1-4-10-5-7-11(8-6-10)9(2)3;1-9(2)11-8-7-10-5-3-4-6-10;1-7(2)11-5-3-8(9,10)4-6-11;1-8(2)10-6-4-9(3)5-7-10;1-8(2)7-9-5-3-4-6-9;1-8(2)9-6-4-3-5-7-9;1-7(2)9-5-3-8-4-6-9;1-7(2)8-3-5-9-6-4-8;1-7(2)8-5-3-4-6-8/h10H,4-9H2,1-3H3;2*9-10H,5-8H2,1-4H3;10H,3-9H2,1-2H3;9-10H,4-8H2,1-3H3;7-9H,4-6H2,1-3H3;2*9H,4-8H2,1-3H3;9H,3-8H2,1-2H3;7H,3-6H2,1-2H3;8H,4-7H2,1-3H3;2*8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3/t;;;;;8-,9-;;;;;;;;;;/m.....0........../s1.
What are the key properties of 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine?
4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine has a molecular weight of 2408.07 g/mol, XLogP of 20.89, 31 rotatable bonds, 1 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-1-propan-2-ylpiperidine;N,1-dimethyl-N-propan-2-ylpiperidin-4-amine;1,4-di(propan-2-yl)piperazine;1-ethyl-4-propan-2-ylpiperazine;1-methyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperidine;(1S,4S)-2-methyl-5-propan-2-yl-2,5-diazabicyclo[2.2.1]heptane;1-methyl-4-(2-propan-2-yloxyethyl)piperazine;1-methyl-4-propan-2-ylpiperazine;1-(2-methylpropyl)pyrrolidine;4-propan-2-ylmorpholine;1-(2-propan-2-yloxyethyl)piperidine;1-(2-propan-2-yloxyethyl)pyrrolidine;1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine is sourced from PubChem (CID 159599369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).