1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone

C14H28N2O2 — CID 60696842

IUPAC1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone
SMILESCCCN(CCO)CC(=O)N1C(C)CCCC1C
InChIInChI=1S/C14H28N2O2/c1-4-8-15(9-10-17)11-14(18)16-12(2)6-5-7-13(16)3/h12-13,17H,4-11H2,1-3H3
InChIKeyGAUHHXKMUUUZKK-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.48
Rot. Bonds6

About 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone

1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone (PubChem CID 60696842) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone.

Molecular Properties

Compound Name1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone
PubChem CID60696842
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone
SMILESCCCN(CCO)CC(=O)N1C(C)CCCC1C
InChIInChI=1S/C14H28N2O2/c1-4-8-15(9-10-17)11-14(18)16-12(2)6-5-7-13(16)3/h12-13,17H,4-11H2,1-3H3
InChIKeyGAUHHXKMUUUZKK-UHFFFAOYSA-N
XLogP1.48
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2,2-difluoroethyl(2-hydroxyethyl)amino]-1-(2,6-dimethylpiperidin-1-yl)ethanone
CID 107485259
2-(dipropylamino)-1-(2-methylpiperidin-1-yl)ethanone
CID 86910557
2-[[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]-prop-2-ynylamino]acetic acid
CID 79283995
2-(2,6-dimethylpiperidin-1-yl)-N-ethyl-N-(2-hydroxyethyl)-2-oxoacetamide
CID 108524852
1-(2,6-dimethylpiperidin-1-yl)-2-[ethyl(piperidin-2-ylmethyl)amino]ethanone
CID 106632312
ethyl (3R)-1-[2-[2-hydroxyethyl(propyl)amino]acetyl]piperidine-3-carboxylate
CID 94458961
1-(2,6-dimethylpiperidin-1-yl)-2-[ethyl(piperidin-4-yl)amino]ethanone
CID 60806605
1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]ethanone
CID 97051854
(2R)-2-[[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]-methylamino]propanoic acid
CID 124835751
N-(4-acetamidophenyl)-2-[[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]-ethylamino]acetamide
CID 51225610
2-(dipropylamino)-1-(2-ethylpiperidin-1-yl)ethanone
CID 86910548
2-[bis(2-hydroxyethyl)amino]-1-piperidin-1-ylethanone
CID 60686615

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone?
The IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone (CID 60696842) is 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone.
What is the SMILES notation for 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone?
The canonical SMILES for 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone is CCCN(CCO)CC(=O)N1C(C)CCCC1C.
What is the InChIKey of 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone?
The InChIKey is GAUHHXKMUUUZKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-4-8-15(9-10-17)11-14(18)16-12(2)6-5-7-13(16)3/h12-13,17H,4-11H2,1-3H3.
What are the key properties of 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone?
1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone has a molecular weight of 256.39 g/mol, XLogP of 1.48, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylpiperidin-1-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone is sourced from PubChem (CID 60696842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).