N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide

C11H20N2O3 — CID 115874792

IUPACN-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide
SMILESCC(=O)N(C)CC(=O)N1CCCC(C)(O)C1
InChIInChI=1S/C11H20N2O3/c1-9(14)12(3)7-10(15)13-6-4-5-11(2,16)8-13/h16H,4-8H2,1-3H3
InChIKeyALAOAHRLDYPPPO-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.16
Rot. Bonds2

About N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide

N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide (PubChem CID 115874792) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide
PubChem CID115874792
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide
SMILESCC(=O)N(C)CC(=O)N1CCCC(C)(O)C1
InChIInChI=1S/C11H20N2O3/c1-9(14)12(3)7-10(15)13-6-4-5-11(2,16)8-13/h16H,4-8H2,1-3H3
InChIKeyALAOAHRLDYPPPO-UHFFFAOYSA-N
XLogP-0.16
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-hydroxy-3-methylpiperidin-1-yl)-3,3-dimethylbutan-1-one
CID 115874379
2-ethoxy-1-(3-hydroxy-3-methylpiperidin-1-yl)ethanone
CID 115874750
3-hydroxy-N,3-dimethylpiperidine-1-carboxamide
CID 115872031
1-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]azepan-2-one
CID 115874722
N-tert-butyl-3-hydroxy-3-methylpiperidine-1-carboxamide
CID 115872033
1-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]pyrrolidin-2-one
CID 115875098
4-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]benzonitrile
CID 115874899
1-(azocan-1-yl)-2-(3-hydroxy-3-methylpiperidin-1-yl)ethanone
CID 115873988
2-(2,6-difluorophenyl)-1-(3-hydroxy-3-methylpiperidin-1-yl)ethanone
CID 115874648
2-(2-bicyclo[2.2.1]heptanyl)-1-(3-hydroxy-3-methylpiperidin-1-yl)ethanone
CID 113344037
N-[2-(3,4-dihydroxypyrrolidin-1-yl)-2-oxoethyl]-N-methylacetamide
CID 106671584
N-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]-N-methylacetamide
CID 63105671

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide?
The IUPAC name of N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide (CID 115874792) is N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide.
What is the SMILES notation for N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide?
The canonical SMILES for N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide is CC(=O)N(C)CC(=O)N1CCCC(C)(O)C1.
What is the InChIKey of N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide?
The InChIKey is ALAOAHRLDYPPPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-9(14)12(3)7-10(15)13-6-4-5-11(2,16)8-13/h16H,4-8H2,1-3H3.
What are the key properties of N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide?
N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide has a molecular weight of 228.29 g/mol, XLogP of -0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide is sourced from PubChem (CID 115874792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).