N-(2-methoxyethyl)-2-methylsulfanylacetamide

C6H13NO2S — CID 19001713

IUPACN-(2-methoxyethyl)-2-methylsulfanylacetamide
SMILESCOCCNC(=O)CSC
InChIInChI=1S/C6H13NO2S/c1-9-4-3-7-6(8)5-10-2/h3-5H2,1-2H3,(H,7,8)
InChIKeyWAYTZZZQIGDZOJ-UHFFFAOYSA-N
MW163.24 g/mol
LogP0.11
Rot. Bonds5

About N-(2-methoxyethyl)-2-methylsulfanylacetamide

N-(2-methoxyethyl)-2-methylsulfanylacetamide (PubChem CID 19001713) has the molecular formula C6H13NO2S and a molecular weight of 163.24 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-methylsulfanylacetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-methylsulfanylacetamide
PubChem CID19001713
Molecular FormulaC6H13NO2S
Molecular Weight163.24 g/mol
Exact Mass163.07
IUPAC NameN-(2-methoxyethyl)-2-methylsulfanylacetamide
SMILESCOCCNC(=O)CSC
InChIInChI=1S/C6H13NO2S/c1-9-4-3-7-6(8)5-10-2/h3-5H2,1-2H3,(H,7,8)
InChIKeyWAYTZZZQIGDZOJ-UHFFFAOYSA-N
XLogP0.11
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.24
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-methoxyethyl)-2-methylsulfanylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-methylsulfanylacetamide?
The IUPAC name of N-(2-methoxyethyl)-2-methylsulfanylacetamide (CID 19001713) is N-(2-methoxyethyl)-2-methylsulfanylacetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-methylsulfanylacetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-methylsulfanylacetamide is COCCNC(=O)CSC.
What is the InChIKey of N-(2-methoxyethyl)-2-methylsulfanylacetamide?
The InChIKey is WAYTZZZQIGDZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2S/c1-9-4-3-7-6(8)5-10-2/h3-5H2,1-2H3,(H,7,8).
What are the key properties of N-(2-methoxyethyl)-2-methylsulfanylacetamide?
N-(2-methoxyethyl)-2-methylsulfanylacetamide has a molecular weight of 163.24 g/mol, XLogP of 0.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-methylsulfanylacetamide is sourced from PubChem (CID 19001713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).