N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide

C13H27NO5 — CID 155715449

IUPACN-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide
SMILESCCCCOCCOCCOCCNC(=O)COC
InChIInChI=1S/C13H27NO5/c1-3-4-6-17-8-10-19-11-9-18-7-5-14-13(15)12-16-2/h3-12H2,1-2H3,(H,14,15)
InChIKeyHWUIXTSLLNIWEF-UHFFFAOYSA-N
MW277.36 g/mol
LogP0.60
Rot. Bonds14

About N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide

N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide (PubChem CID 155715449) has the molecular formula C13H27NO5 and a molecular weight of 277.36 g/mol. Its IUPAC name is N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide
PubChem CID155715449
Molecular FormulaC13H27NO5
Molecular Weight277.36 g/mol
Exact Mass277.19
IUPAC NameN-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide
SMILESCCCCOCCOCCOCCNC(=O)COC
InChIInChI=1S/C13H27NO5/c1-3-4-6-17-8-10-19-11-9-18-7-5-14-13(15)12-16-2/h3-12H2,1-2H3,(H,14,15)
InChIKeyHWUIXTSLLNIWEF-UHFFFAOYSA-N
XLogP0.60
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide;ethane;methane
CID 178085327
2-methoxy-N-(3-propoxypropyl)acetamide
CID 82947081
N-[2-(2-butoxyethoxy)ethyl]propanamide
CID 153105198
N-[2-[2-[(2-methoxyacetyl)amino]ethoxy]ethyl]propanamide
CID 118258329
2-[2-(2-butoxyethoxy)ethoxy]-N-butylacetamide
CID 155190113
N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide
CID 155056819
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]pentanamide
CID 134259653
2-butoxy-N-[2-[2-(2-oxoethoxy)ethoxy]ethyl]acetamide
CID 172626027
2-methoxy-N-[2-[2-[2-[2-(3-oxobutoxy)ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 118668919
2-(2-butoxyethoxy)-N-(2-hydroxyethyl)acetamide
CID 89471630
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[(2-methoxyacetyl)amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 155320272
N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide
CID 89176591

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide?
The IUPAC name of N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide (CID 155715449) is N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide.
What is the SMILES notation for N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide?
The canonical SMILES for N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide is CCCCOCCOCCOCCNC(=O)COC.
What is the InChIKey of N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide?
The InChIKey is HWUIXTSLLNIWEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO5/c1-3-4-6-17-8-10-19-11-9-18-7-5-14-13(15)12-16-2/h3-12H2,1-2H3,(H,14,15).
What are the key properties of N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide?
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide has a molecular weight of 277.36 g/mol, XLogP of 0.60, 14 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide is sourced from PubChem (CID 155715449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).