1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one

C83H156N8O14 — CID 159909659

IUPAC1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one
SMILESCC(C)(C)CC(=O)C1CCN(C(=O)COC(C)(C)C)CC1.CC(C)(C)OCC(=O)N1CCC(NC(=O)C(C)(C)C)CC1.CC(C)(C)OCC(=O)N1CCN(C(C)(C)C)CC1.CC(C)OCC(=O)N1CCC(C(=O)CCCC(C)(C)C)CC1.CC(C)OCC(=O)N1CCC(NC(=O)CCCC(C)(C)C)CC1
InChIInChI=1S/C18H34N2O3.C18H33NO3.C17H31NO3.C16H30N2O3.C14H28N2O2/c1-14(2)23-13-17(22)20-11-8-15(9-12-20)19-16(21)7-6-10-18(3,4)5;1-14(2)22-13-17(21)19-11-8-15(9-12-19)16(20)7-6-10-18(3,4)5;1-16(2,3)11-14(19)13-7-9-18(10-8-13)15(20)12-21-17(4,5)6;1-15(2,3)14(20)17-12-7-9-18(10-8-12)13(19)11-21-16(4,5)6;1-13(2,3)16-9-7-15(8-10-16)12(17)11-18-14(4,5)6/h14-15H,6-13H2,1-5H3,(H,19,21);14-15H,6-13H2,1-5H3;13H,7-12H2,1-6H3;12H,7-11H2,1-6H3,(H,17,20);7-11H2,1-6H3
InChIKeyNXAFENVXUQWDRD-UHFFFAOYSA-N
MW1490.20 g/mol
LogP12.91
Rot. Bonds23

About 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one

1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one (PubChem CID 159909659) has the molecular formula C83H156N8O14 and a molecular weight of 1490.20 g/mol. Its IUPAC name is 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one.

Molecular Properties

Compound Name1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one
PubChem CID159909659
Molecular FormulaC83H156N8O14
Molecular Weight1490.20 g/mol
Exact Mass1489.17
IUPAC Name1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one
SMILESCC(C)(C)CC(=O)C1CCN(C(=O)COC(C)(C)C)CC1.CC(C)(C)OCC(=O)N1CCC(NC(=O)C(C)(C)C)CC1.CC(C)(C)OCC(=O)N1CCN(C(C)(C)C)CC1.CC(C)OCC(=O)N1CCC(C(=O)CCCC(C)(C)C)CC1.CC(C)OCC(=O)N1CCC(NC(=O)CCCC(C)(C)C)CC1
InChIInChI=1S/C18H34N2O3.C18H33NO3.C17H31NO3.C16H30N2O3.C14H28N2O2/c1-14(2)23-13-17(22)20-11-8-15(9-12-20)19-16(21)7-6-10-18(3,4)5;1-14(2)22-13-17(21)19-11-8-15(9-12-19)16(20)7-6-10-18(3,4)5;1-16(2,3)11-14(19)13-7-9-18(10-8-13)15(20)12-21-17(4,5)6;1-15(2,3)14(20)17-12-7-9-18(10-8-12)13(19)11-21-16(4,5)6;1-13(2,3)16-9-7-15(8-10-16)12(17)11-18-14(4,5)6/h14-15H,6-13H2,1-5H3,(H,19,21);14-15H,6-13H2,1-5H3;13H,7-12H2,1-6H3;12H,7-11H2,1-6H3,(H,17,20);7-11H2,1-6H3
InChIKeyNXAFENVXUQWDRD-UHFFFAOYSA-N
XLogP12.91
TPSA243.28 Ų
H-Bond Donors2
H-Bond Acceptors15
Rotatable Bonds23
Heavy Atoms105
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001490.20
LogP ≤ 512.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1015

Analyze 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one with MolForge

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Related Compounds

1-[2-(tert-butylamino)acetyl]-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;1-(2-tert-butylsulfanylacetyl)-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidine-4-carboxamide;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one;2-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 157227010
1-[2-(tert-butylamino)acetyl]-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidine-4-carboxamide;3,3-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]butan-1-one;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one;2,2-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]propanamide;2-propan-2-yloxy-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 157616871
1-[2-(tert-butylamino)acetyl]-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;2-(tert-butylamino)-1-(4-tert-butylpiperidin-1-yl)ethanone;1-(4-tert-butylpiperidin-1-yl)-2-tert-butylsulfanylethanone;1-(4-tert-butylpiperidin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;1-(2-tert-butylsulfanylacetyl)-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidine-4-carboxamide;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one
CID 158073585
1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;4-(2,2-dimethylpropoxy)-1-[(2-methylpropan-2-yl)oxymethyl]piperidine;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;N-(2,2-dimethylpropyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[(2-methylpropan-2-yl)oxymethyl]piperidin-4-yl]methyl]propan-2-amine
CID 158331586
1-[2-(tert-butylamino)acetyl]-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;2-(tert-butylamino)-1-(4-tert-butylpiperidin-1-yl)ethanone;1-(4-tert-butylpiperidin-1-yl)-2-tert-butylsulfanylethanone;bis(1-(4-tert-butylpiperidin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone);1-(2-tert-butylsulfanylacetyl)-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidine-4-carboxamide;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;5,5-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]hexanamide;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one;2-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 158610909
3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;5,5-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]hexan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;methane;2-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 158665304
N-[2-(diethylamino)ethyl]-2-methylpropanamide;N-[2-(dimethylamino)ethyl]-2-methylpropanamide;N-[1-(dimethylamino)propan-2-yl]-2-methylpropanamide;1,2-dimethyl-4-(2-methylpropyl)piperazine;N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-methylpropanamide;N-[2-[ethyl(methyl)amino]ethyl]-2-methylpropanamide;2-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]propanamide;2-methyl-N-(1-methylpiperidin-4-yl)propanamide;1-methyl-4-(2-methylpropyl)piperazine;2-methyl-N-(2-piperidin-1-ylethyl)propanamide;2-methyl-6-piperidin-1-ylhexan-3-one;2-methyl-N-piperidin-3-ylpropanamide;1-[2-(2-methylpropoxy)ethyl]piperidine;1-(2-methylpropyl)-4-propylpiperazine;1,2,2-trimethyl-4-(2-methylpropyl)piperazine
CID 158796046
1-[2-(tert-butylamino)acetyl]-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one;2,2-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]propanamide;2-propan-2-yloxy-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 158920712
1-[2-(tert-butylamino)acetyl]-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;1-(2-tert-butylsulfanylacetyl)-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidine-4-carboxamide;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one
CID 159074569
1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine;N-[3-[2-(4-tert-butylpiperazin-1-yl)ethoxy]propyl]-2-methylpropan-2-amine;N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-2-amine;4,4-dimethyl-1-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pentan-1-one;N-(2,2-dimethylpropyl)-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]acetamide;2-methyl-N-[2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]ethyl]propan-2-amine;2-methyl-N-[3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propyl]propan-2-amine;2-methyl-N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methyl]propan-2-amine
CID 159363779
1-[2-(tert-butylamino)acetyl]-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidine-4-carboxamide;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one;2-[(2-methylpropan-2-yl)oxy]-1-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 159439980
1-[2-(tert-butylamino)acetyl]-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;1-(2-tert-butylsulfanylacetyl)-N-(3,3-dimethylbutyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-(4,4-dimethylpentanoyl)piperidine-4-carboxamide;N-(3,3-dimethylbutyl)-1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidine-4-carboxamide;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one
CID 159906220

Frequently Asked Questions

What is the IUPAC name of 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one?
The IUPAC name of 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one (CID 159909659) is 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one.
What is the SMILES notation for 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one?
The canonical SMILES for 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one is CC(C)(C)CC(=O)C1CCN(C(=O)COC(C)(C)C)CC1.CC(C)(C)OCC(=O)N1CCC(NC(=O)C(C)(C)C)CC1.CC(C)(C)OCC(=O)N1CCN(C(C)(C)C)CC1.CC(C)OCC(=O)N1CCC(C(=O)CCCC(C)(C)C)CC1.CC(C)OCC(=O)N1CCC(NC(=O)CCCC(C)(C)C)CC1.
What is the InChIKey of 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one?
The InChIKey is NXAFENVXUQWDRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O3.C18H33NO3.C17H31NO3.C16H30N2O3.C14H28N2O2/c1-14(2)23-13-17(22)20-11-8-15(9-12-20)19-16(21)7-6-10-18(3,4)5;1-14(2)22-13-17(21)19-11-8-15(9-12-19)16(20)7-6-10-18(3,4)5;1-16(2,3)11-14(19)13-7-9-18(10-8-13)15(20)12-21-17(4,5)6;1-15(2,3)14(20)17-12-7-9-18(10-8-12)13(19)11-21-16(4,5)6;1-13(2,3)16-9-7-15(8-10-16)12(17)11-18-14(4,5)6/h14-15H,6-13H2,1-5H3,(H,19,21);14-15H,6-13H2,1-5H3;13H,7-12H2,1-6H3;12H,7-11H2,1-6H3,(H,17,20);7-11H2,1-6H3.
What are the key properties of 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one?
1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one has a molecular weight of 1490.20 g/mol, XLogP of 12.91, 23 rotatable bonds, 2 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-tert-butylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]ethanone;3,3-dimethyl-1-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]butan-1-one;2,2-dimethyl-N-[1-[2-[(2-methylpropan-2-yl)oxy]acetyl]piperidin-4-yl]propanamide;5,5-dimethyl-N-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexanamide;5,5-dimethyl-1-[1-(2-propan-2-yloxyacetyl)piperidin-4-yl]hexan-1-one is sourced from PubChem (CID 159909659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).