N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide

C11H20N2O3 — CID 114679928

IUPACN-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide
SMILESCC(=O)N(C)CC(=O)N1CCC(O)C(C)C1
InChIInChI=1S/C11H20N2O3/c1-8-6-13(5-4-10(8)15)11(16)7-12(3)9(2)14/h8,10,15H,4-7H2,1-3H3
InChIKeyFLTYOZSBBWKAFS-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.31
Rot. Bonds2

About N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide

N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide (PubChem CID 114679928) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide
PubChem CID114679928
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide
SMILESCC(=O)N(C)CC(=O)N1CCC(O)C(C)C1
InChIInChI=1S/C11H20N2O3/c1-8-6-13(5-4-10(8)15)11(16)7-12(3)9(2)14/h8,10,15H,4-7H2,1-3H3
InChIKeyFLTYOZSBBWKAFS-UHFFFAOYSA-N
XLogP-0.31
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 ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3,4-dihydroxypyrrolidin-1-yl)-2-oxoethyl]-N-methylacetamide
CID 106671584
1-(4-hydroxy-3-methylpiperidin-1-yl)-2-sulfanylethanone
CID 114683823
2-chloro-1-(4-hydroxy-3-methylpiperidin-1-yl)ethanone
CID 114678152
N-[2-(3-hydroxyazetidin-1-yl)-2-oxoethyl]-N-methylacetamide
CID 63105671
1-[(3S,4R)-4-hydroxy-3-methylpiperidin-1-yl]ethanone
CID 129394019
1-(4-hydroxy-3-methylpiperidin-1-yl)-2-methylsulfanylethanone
CID 114680336
1-(4-hydroxy-3-methylpiperidin-1-yl)-3,3-dimethylbutan-1-one
CID 114501416
3-chloro-1-[(3S,4R)-4-hydroxy-3-methylpiperidin-1-yl]propan-1-one
CID 129380940
2-[(5-chloro-2-pyridinyl)-methylamino]-1-(4-hydroxy-3-methylpiperidin-1-yl)ethanone
CID 114679848
2-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethoxy]acetic acid
CID 114678072
methyl 1-[2-[acetyl(methyl)amino]acetyl]piperidine-3-carboxylate
CID 78919197
1-[(3S,4R)-4-hydroxy-3-methylpiperidin-1-yl]-2-piperidin-4-ylethanone
CID 129394622

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide?
The IUPAC name of N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide (CID 114679928) is N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide.
What is the SMILES notation for N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide?
The canonical SMILES for N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide is CC(=O)N(C)CC(=O)N1CCC(O)C(C)C1.
What is the InChIKey of N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide?
The InChIKey is FLTYOZSBBWKAFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-8-6-13(5-4-10(8)15)11(16)7-12(3)9(2)14/h8,10,15H,4-7H2,1-3H3.
What are the key properties of N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide?
N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide has a molecular weight of 228.29 g/mol, XLogP of -0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxy-3-methylpiperidin-1-yl)-2-oxoethyl]-N-methylacetamide is sourced from PubChem (CID 114679928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).