3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one

C125H240N10O10 — CID 159899988

IUPAC3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one
SMILESCC(=O)N1CCC(C(C)C)CC1.CC(C)C(=O)N1CCC(C(C)C)CC1.CC(C)C1CCN(C(=O)C(C)(C)C)CC1.CC(C)C1CCN(C(=O)CC(C)(C)C)CC1.CC(C)CC(=O)N1CCC(C(C)C)CC1.CC(C)CCC(=O)N1CCC(C(C)C)CC1.CCC(=O)N1CCC(C(C)C)CC1.CCC(C)C(=O)N1CCC(C(C)C)CC1.CCCC(=O)N1CCC(C(C)C)CC1.CCCCC(=O)N1CCC(C(C)C)CC1
InChIInChI=1S/2C14H27NO.4C13H25NO.2C12H23NO.C11H21NO.C10H19NO/c1-11(2)12-6-8-15(9-7-12)13(16)10-14(3,4)5;1-11(2)5-6-14(16)15-9-7-13(8-10-15)12(3)4;1-10(2)11-6-8-14(9-7-11)12(15)13(3,4)5;1-10(2)9-13(15)14-7-5-12(6-8-14)11(3)4;1-5-11(4)13(15)14-8-6-12(7-9-14)10(2)3;1-4-5-6-13(15)14-9-7-12(8-10-14)11(2)3;1-9(2)11-5-7-13(8-6-11)12(14)10(3)4;1-4-5-12(14)13-8-6-11(7-9-13)10(2)3;1-4-11(13)12-7-5-10(6-8-12)9(2)3;1-8(2)10-4-6-11(7-5-10)9(3)12/h11-12H,6-10H2,1-5H3;11-13H,5-10H2,1-4H3;10-11H,6-9H2,1-5H3;2*10-12H,5-9H2,1-4H3;11-12H,4-10H2,1-3H3;9-11H,5-8H2,1-4H3;10-11H,4-9H2,1-3H3;9-10H,4-8H2,1-3H3;8,10H,4-7H2,1-3H3
InChIKeyNVVFOKGJVWLXRS-UHFFFAOYSA-N
MW2043.35 g/mol
LogP27.90
Rot. Bonds25

About 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one

3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one (PubChem CID 159899988) has the molecular formula C125H240N10O10 and a molecular weight of 2043.35 g/mol. Its IUPAC name is 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one.

Molecular Properties

Compound Name3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one
PubChem CID159899988
Molecular FormulaC125H240N10O10
Molecular Weight2043.35 g/mol
Exact Mass2041.86
IUPAC Name3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one
SMILESCC(=O)N1CCC(C(C)C)CC1.CC(C)C(=O)N1CCC(C(C)C)CC1.CC(C)C1CCN(C(=O)C(C)(C)C)CC1.CC(C)C1CCN(C(=O)CC(C)(C)C)CC1.CC(C)CC(=O)N1CCC(C(C)C)CC1.CC(C)CCC(=O)N1CCC(C(C)C)CC1.CCC(=O)N1CCC(C(C)C)CC1.CCC(C)C(=O)N1CCC(C(C)C)CC1.CCCC(=O)N1CCC(C(C)C)CC1.CCCCC(=O)N1CCC(C(C)C)CC1
InChIInChI=1S/2C14H27NO.4C13H25NO.2C12H23NO.C11H21NO.C10H19NO/c1-11(2)12-6-8-15(9-7-12)13(16)10-14(3,4)5;1-11(2)5-6-14(16)15-9-7-13(8-10-15)12(3)4;1-10(2)11-6-8-14(9-7-11)12(15)13(3,4)5;1-10(2)9-13(15)14-7-5-12(6-8-14)11(3)4;1-5-11(4)13(15)14-8-6-12(7-9-14)10(2)3;1-4-5-6-13(15)14-9-7-12(8-10-14)11(2)3;1-9(2)11-5-7-13(8-6-11)12(14)10(3)4;1-4-5-12(14)13-8-6-11(7-9-13)10(2)3;1-4-11(13)12-7-5-10(6-8-12)9(2)3;1-8(2)10-4-6-11(7-5-10)9(3)12/h11-12H,6-10H2,1-5H3;11-13H,5-10H2,1-4H3;10-11H,6-9H2,1-5H3;2*10-12H,5-9H2,1-4H3;11-12H,4-10H2,1-3H3;9-11H,5-8H2,1-4H3;10-11H,4-9H2,1-3H3;9-10H,4-8H2,1-3H3;8,10H,4-7H2,1-3H3
InChIKeyNVVFOKGJVWLXRS-UHFFFAOYSA-N
XLogP27.90
TPSA203.10 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds25
Heavy Atoms145
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002043.35
LogP ≤ 527.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one 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

4,4-Difluoro-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3,3-difluoro-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2,2,3,3,3-pentafluoro-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;3,3,3-trifluoro-2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;3,3,3-trifluoro-2-methyl-1-(4-propan-2-ylpiperidin-1-yl)-2-(trifluoromethyl)propan-1-one;4,4,4-trifluoro-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2,2-trifluoro-1-(4-propan-2-ylpiperidin-1-yl)ethanone;3,3,3-trifluoro-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;3,3,3-trifluoro-1-(4-propan-2-ylpiperidin-1-yl)-2-(trifluoromethyl)propan-1-one
CID 160075892
2,2-Dimethyl-1-(4-methylpiperazin-1-yl)propan-1-one;2-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;2-methyl-1-(4-methylpiperazin-1-yl)pentan-1-one;3-methyl-1-(4-methylpiperazin-1-yl)pentan-1-one;2-methyl-1-(4-methylpiperazin-1-yl)propan-1-one;1-(4-methylpiperazin-1-yl)butan-1-one;1-(4-methylpiperazin-1-yl)ethanone;1-(4-methylpiperazin-1-yl)heptan-1-one;1-(4-methylpiperazin-1-yl)hexan-1-one;1-(4-methylpiperazin-1-yl)pentan-1-one;1-(4-methylpiperazin-1-yl)propan-1-one
CID 157421676
1-(4-Tert-butyl-2,2,3,3,4,5,5,6,6-nonadeuteriopiperidin-1-yl)ethanone;1-(4-tert-butyl-2,2,3,3,5,5,6,6-octadeuteriopiperidin-1-yl)ethanone;4-tert-butyl-2,2,3,3,4-pentadeuteriopiperidine-1-carboxamide;4-tert-butyl-3,3,4,5,5-pentadeuteriopiperidine-1-carboxamide;4-tert-butyl-2,2,3,3-tetradeuteriopiperidine-1-carboxamide;1-(4-tert-butyl-2,2,6,6-tetradeuteriopiperidin-1-yl)ethanone;1-(4-tert-butyl-3,3,5,5-tetradeuteriopiperidin-1-yl)ethanone;methane
CID 157965041
4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]propan-1-one
CID 158034861
1-(4-Tert-butyl-2,2,3,3,4,5,5,6,6-nonadeuteriopiperidin-1-yl)ethanone;1-(4-tert-butyl-2,2,3,3,5,5,6,6-octadeuteriopiperidin-1-yl)ethanone;1-(4-tert-butyl-2,2,3,3,4-pentadeuteriopiperidin-1-yl)ethanone;1-(4-tert-butyl-3,3,4,5,5-pentadeuteriopiperidin-1-yl)ethanone;1-(4-tert-butyl-2,2,3,3-tetradeuteriopiperidin-1-yl)ethanone;1-(4-tert-butyl-2,2,6,6-tetradeuteriopiperidin-1-yl)ethanone;1-(4-tert-butyl-3,3,5,5-tetradeuteriopiperidin-1-yl)ethanone;methane
CID 159520021
4-tert-butyl-N,N-diethylpiperazine-1-carboxamide;4-tert-butyl-N,N-dimethylpiperazine-1-carboxamide;4-tert-butyl-N-ethyl-N-methylpiperazine-1-carboxamide;4-tert-butyl-N-methyl-N-propan-2-ylpiperazine-1-carboxamide;1-(4-tert-butylpiperazin-1-yl)butan-1-one;1-(4-tert-butylpiperazin-1-yl)-3,3-dimethylbutan-1-one;1-(4-tert-butylpiperazin-1-yl)-3-methylbutan-1-one;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide;4-methyl-1-(4-propan-2-ylpiperazin-1-yl)pentan-1-one
CID 159660905
4-tert-butyl-N,N-dimethylpiperidine-1-carboxamide;4-tert-butyl-1-ethylpiperidine;1-(4-tert-butylpiperidin-1-yl)propan-1-one;4-tert-butyl-1-propylpiperidine;1-[4-(2,2-dimethylpropyl)piperidin-1-yl]ethanone
CID 159933974
1-[4-(Dimethylamino)piperidin-1-yl]-3-methylbutan-1-one;2,3-dimethyl-1-(4-methylpiperazin-1-yl)butan-1-one;1-(4,4-dimethylpiperazin-4-ium-1-yl)-2,3-dimethylbutan-1-one;1-(4,4-dimethylpiperazin-4-ium-1-yl)-3-methylbutan-1-one;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;bis(3-methyl-1-piperidin-1-ylbutan-1-one);3-methyl-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one
CID 160066406
3,3-Dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4,4-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one
CID 160445130
N,N-diethyl-4-propan-2-ylpiperazine-1-carboxamide;N,N-dimethyl-4-propan-2-ylpiperazine-1-carboxamide;3,3-dimethyl-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;N-ethyl-N-methyl-4-propan-2-ylpiperazine-1-carboxamide;N-methyl-N-(2-methylpropyl)-4-propan-2-ylpiperazine-1-carboxamide;3-methyl-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperazin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperazin-1-yl)butan-1-one;1-(4-propan-2-ylpiperazin-1-yl)propan-1-one
CID 161402070
1-[4-(Dimethylamino)piperidin-1-yl]-3-methylbutan-1-one;2,3-dimethyl-1-(4-methylpiperazin-1-yl)butan-1-one;1-(4,4-dimethylpiperazin-4-ium-1-yl)-2,3-dimethylbutan-1-one;1-(4,4-dimethylpiperazin-4-ium-1-yl)-3-methylbutan-1-one;methane;3-methyl-1-(4-methylpiperazin-1-yl)butan-1-one;bis(3-methyl-1-piperidin-1-ylbutan-1-one);3-methyl-1-(4-propan-2-ylpiperazin-1-yl)butan-1-one
CID 161474083
1-[2-[1-(3-Methylbutyl)piperidin-4-yl]ethyl]-4-(2-methylpropyl)piperazine;1-[[1-(3-methylbutyl)piperidin-4-yl]methyl]-4-(2-methylpropyl)piperazine;1-[3-[1-(3-methylbutyl)piperidin-4-yl]propyl]-4-(2-methylpropyl)piperazine;2-methyl-1-[4-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]piperidin-1-yl]propan-1-one;2-methyl-1-[4-[[4-(2-methylpropyl)piperazin-1-yl]methyl]piperidin-1-yl]propan-1-one;2-methyl-1-[4-[3-[4-(2-methylpropyl)piperazin-1-yl]propyl]piperidin-1-yl]propan-1-one;1-(2-methylpropyl)-4-[2-[1-(2-methylpropyl)piperidin-4-yl]ethyl]piperazine;1-(2-methylpropyl)-4-[[1-(2-methylpropyl)piperidin-4-yl]methyl]piperazine;1-(2-methylpropyl)-4-[3-[1-(2-methylpropyl)piperidin-4-yl]propyl]piperazine
CID 167538507

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one?
The IUPAC name of 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one (CID 159899988) is 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one.
What is the SMILES notation for 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one?
The canonical SMILES for 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one is CC(=O)N1CCC(C(C)C)CC1.CC(C)C(=O)N1CCC(C(C)C)CC1.CC(C)C1CCN(C(=O)C(C)(C)C)CC1.CC(C)C1CCN(C(=O)CC(C)(C)C)CC1.CC(C)CC(=O)N1CCC(C(C)C)CC1.CC(C)CCC(=O)N1CCC(C(C)C)CC1.CCC(=O)N1CCC(C(C)C)CC1.CCC(C)C(=O)N1CCC(C(C)C)CC1.CCCC(=O)N1CCC(C(C)C)CC1.CCCCC(=O)N1CCC(C(C)C)CC1.
What is the InChIKey of 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one?
The InChIKey is NVVFOKGJVWLXRS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C14H27NO.4C13H25NO.2C12H23NO.C11H21NO.C10H19NO/c1-11(2)12-6-8-15(9-7-12)13(16)10-14(3,4)5;1-11(2)5-6-14(16)15-9-7-13(8-10-15)12(3)4;1-10(2)11-6-8-14(9-7-11)12(15)13(3,4)5;1-10(2)9-13(15)14-7-5-12(6-8-14)11(3)4;1-5-11(4)13(15)14-8-6-12(7-9-14)10(2)3;1-4-5-6-13(15)14-9-7-12(8-10-14)11(2)3;1-9(2)11-5-7-13(8-6-11)12(14)10(3)4;1-4-5-12(14)13-8-6-11(7-9-13)10(2)3;1-4-11(13)12-7-5-10(6-8-12)9(2)3;1-8(2)10-4-6-11(7-5-10)9(3)12/h11-12H,6-10H2,1-5H3;11-13H,5-10H2,1-4H3;10-11H,6-9H2,1-5H3;2*10-12H,5-9H2,1-4H3;11-12H,4-10H2,1-3H3;9-11H,5-8H2,1-4H3;10-11H,4-9H2,1-3H3;9-10H,4-8H2,1-3H3;8,10H,4-7H2,1-3H3.
What are the key properties of 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one?
3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one has a molecular weight of 2043.35 g/mol, XLogP of 27.90, 25 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;2,2-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;3-methyl-1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;4-methyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;2-methyl-1-(4-propan-2-ylpiperidin-1-yl)propan-1-one;1-(4-propan-2-ylpiperidin-1-yl)butan-1-one;1-(4-propan-2-ylpiperidin-1-yl)ethanone;1-(4-propan-2-ylpiperidin-1-yl)pentan-1-one;1-(4-propan-2-ylpiperidin-1-yl)propan-1-one is sourced from PubChem (CID 159899988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).