2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone

C15H28N2O3 — CID 114779696

IUPAC2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone
SMILESCC1CCN(C(=O)CN2CC(CO)OC(C)(C)C2)CC1
InChIInChI=1S/C15H28N2O3/c1-12-4-6-17(7-5-12)14(19)9-16-8-13(10-18)20-15(2,3)11-16/h12-13,18H,4-11H2,1-3H3
InChIKeyWDLOOYJBLCNZBY-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.72
Rot. Bonds3

About 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone

2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone (PubChem CID 114779696) has the molecular formula C15H28N2O3 and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone
PubChem CID114779696
Molecular FormulaC15H28N2O3
Molecular Weight284.40 g/mol
Exact Mass284.21
IUPAC Name2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone
SMILESCC1CCN(C(=O)CN2CC(CO)OC(C)(C)C2)CC1
InChIInChI=1S/C15H28N2O3/c1-12-4-6-17(7-5-12)14(19)9-16-8-13(10-18)20-15(2,3)11-16/h12-13,18H,4-11H2,1-3H3
InChIKeyWDLOOYJBLCNZBY-UHFFFAOYSA-N
XLogP0.72
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone 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

2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-morpholin-4-ylethanone
CID 114779666
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(2-methylmorpholin-4-yl)ethanone
CID 114779881
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]acetamide
CID 114779554
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-N-(oxan-4-yl)acetamide
CID 114779721
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]ethanol
CID 114779184
4-[[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]methyl]benzoic acid
CID 114777324
[4-[(5,5-dimethyloxolan-2-yl)methyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114780051
5-[[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]methyl]-1-methylpyrazole-4-carboxylic acid
CID 114777296
[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-(3-methyloxolan-2-yl)methanone
CID 114778389
[6,6-dimethyl-4-[[4-methyl-1-(methylaminomethyl)cyclohexyl]methyl]morpholin-2-yl]methanol
CID 114780342
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 114777452
[4-(2-aminoethyl)-6,6-dimethylmorpholin-2-yl]methanol
CID 114776413

Frequently Asked Questions

What is the IUPAC name of 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone?
The IUPAC name of 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone (CID 114779696) is 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone?
The canonical SMILES for 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone is CC1CCN(C(=O)CN2CC(CO)OC(C)(C)C2)CC1.
What is the InChIKey of 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone?
The InChIKey is WDLOOYJBLCNZBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3/c1-12-4-6-17(7-5-12)14(19)9-16-8-13(10-18)20-15(2,3)11-16/h12-13,18H,4-11H2,1-3H3.
What are the key properties of 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone?
2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone has a molecular weight of 284.40 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(hydroxymethyl)-2,2-dimethylmorpholin-4-yl]-1-(4-methylpiperidin-1-yl)ethanone is sourced from PubChem (CID 114779696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).