N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide

C14H28N2O5 — CID 155056819

IUPACN-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide
SMILESCOCC(=O)NCCOCCOCCCCCNC(C)=O
InChIInChI=1S/C14H28N2O5/c1-13(17)15-6-4-3-5-8-20-10-11-21-9-7-16-14(18)12-19-2/h3-12H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyNCCARKRLDIMBIR-UHFFFAOYSA-N
MW304.39 g/mol
LogP0.09
Rot. Bonds14

About N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide

N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide (PubChem CID 155056819) has the molecular formula C14H28N2O5 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide
PubChem CID155056819
Molecular FormulaC14H28N2O5
Molecular Weight304.39 g/mol
Exact Mass304.20
IUPAC NameN-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide
SMILESCOCC(=O)NCCOCCOCCCCCNC(C)=O
InChIInChI=1S/C14H28N2O5/c1-13(17)15-6-4-3-5-8-20-10-11-21-9-7-16-14(18)12-19-2/h3-12H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyNCCARKRLDIMBIR-UHFFFAOYSA-N
XLogP0.09
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[5-(5-acetamidopentoxy)pentyl]-2-methoxyacetamide;ethane
CID 163400462
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide
CID 155715449
N-[5-[2-(5-acetamidopentoxy)ethoxy]pentyl]-2-propan-2-yloxyacetamide
CID 142616275
2-methoxy-N-(6-methoxyhexyl)acetamide
CID 177338017
N-[4-(3-methoxypropoxy)butyl]acetamide
CID 134356384
N-[3-(2-methoxyethoxy)propyl]acetamide
CID 60668585
ethane;2-methoxy-N-[3-[4-(methylamino)butoxy]propyl]acetamide
CID 176551860
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-2-methoxyacetamide;ethane;methane
CID 178085327
2-methoxy-N-[2-[2-[2-[2-(3-oxobutoxy)ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 118668919
ethane;N-[3-(2-methoxyethoxy)propyl]acetamide
CID 177221846
N-[2-[2-(2-acetamidoethoxy)ethoxy]ethyl]acetamide
CID 18674787
2-methoxy-N-(3-propoxypropyl)acetamide
CID 82947081

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide?
The IUPAC name of N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide (CID 155056819) is N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide.
What is the SMILES notation for N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide?
The canonical SMILES for N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide is COCC(=O)NCCOCCOCCCCCNC(C)=O.
What is the InChIKey of N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide?
The InChIKey is NCCARKRLDIMBIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O5/c1-13(17)15-6-4-3-5-8-20-10-11-21-9-7-16-14(18)12-19-2/h3-12H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide?
N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide has a molecular weight of 304.39 g/mol, XLogP of 0.09, 14 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(5-acetamidopentoxy)ethoxy]ethyl]-2-methoxyacetamide is sourced from PubChem (CID 155056819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).