2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide

C12H22N2O4 — CID 108505067

IUPAC2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide
SMILESCOCCNC(=O)C(=O)N1CCCCC1CCO
InChIInChI=1S/C12H22N2O4/c1-18-9-6-13-11(16)12(17)14-7-3-2-4-10(14)5-8-15/h10,15H,2-9H2,1H3,(H,13,16)
InChIKeyBFQBTUVXRBBUGC-UHFFFAOYSA-N
MW258.32 g/mol
LogP-0.49
Rot. Bonds5

About 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide

2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide (PubChem CID 108505067) has the molecular formula C12H22N2O4 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide.

Molecular Properties

Compound Name2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide
PubChem CID108505067
Molecular FormulaC12H22N2O4
Molecular Weight258.32 g/mol
Exact Mass258.16
IUPAC Name2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide
SMILESCOCCNC(=O)C(=O)N1CCCCC1CCO
InChIInChI=1S/C12H22N2O4/c1-18-9-6-13-11(16)12(17)14-7-3-2-4-10(14)5-8-15/h10,15H,2-9H2,1H3,(H,13,16)
InChIKeyBFQBTUVXRBBUGC-UHFFFAOYSA-N
XLogP-0.49
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide 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-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxo-N-prop-2-enylacetamide
CID 108526472
2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxo-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
CID 108530292
N-(2-hydroxyethyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
CID 108523374
2-hydroxy-1-[2-(2-methoxyethyl)piperidin-1-yl]ethanone
CID 77474029
N-(2-chloroethyl)-2-(2-ethylpiperidin-1-yl)-2-oxoacetamide
CID 108513905
N-(2,5-dimethylphenyl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetamide
CID 108531033
2-(2-hydroxyethyl)-N-propan-2-ylpiperidine-1-carboxamide
CID 60956630
N-(5-chloro-2-methylphenyl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetamide
CID 108511874
2-[2-(hydroxymethyl)piperidin-1-yl]-N-(2-methoxyethyl)acetamide
CID 60684865
2-[[2-(2-hydroxyethyl)piperidine-1-carbonyl]amino]acetic acid
CID 43445645
2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(3-methylphenyl)-2-oxoacetamide
CID 108515753
2-amino-N-[2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetyl]benzamide
CID 108529491

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide?
The IUPAC name of 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide (CID 108505067) is 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide.
What is the SMILES notation for 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide?
The canonical SMILES for 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide is COCCNC(=O)C(=O)N1CCCCC1CCO.
What is the InChIKey of 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide?
The InChIKey is BFQBTUVXRBBUGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O4/c1-18-9-6-13-11(16)12(17)14-7-3-2-4-10(14)5-8-15/h10,15H,2-9H2,1H3,(H,13,16).
What are the key properties of 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide?
2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide has a molecular weight of 258.32 g/mol, XLogP of -0.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethyl)piperidin-1-yl]-N-(2-methoxyethyl)-2-oxoacetamide is sourced from PubChem (CID 108505067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).