2-(2-methoxyethoxy)butanamide

C7H15NO3 — CID 62900293

IUPAC2-(2-methoxyethoxy)butanamide
SMILESCCC(OCCOC)C(N)=O
InChIInChI=1S/C7H15NO3/c1-3-6(7(8)9)11-5-4-10-2/h6H,3-5H2,1-2H3,(H2,8,9)
InChIKeyYMMOWDYMLYZCLG-UHFFFAOYSA-N
MW161.20 g/mol
LogP-0.09
Rot. Bonds6

About 2-(2-methoxyethoxy)butanamide

2-(2-methoxyethoxy)butanamide (PubChem CID 62900293) has the molecular formula C7H15NO3 and a molecular weight of 161.20 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)butanamide.

Molecular Properties

Compound Name2-(2-methoxyethoxy)butanamide
PubChem CID62900293
Molecular FormulaC7H15NO3
Molecular Weight161.20 g/mol
Exact Mass161.11
IUPAC Name2-(2-methoxyethoxy)butanamide
SMILESCCC(OCCOC)C(N)=O
InChIInChI=1S/C7H15NO3/c1-3-6(7(8)9)11-5-4-10-2/h6H,3-5H2,1-2H3,(H2,8,9)
InChIKeyYMMOWDYMLYZCLG-UHFFFAOYSA-N
XLogP-0.09
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 5-0.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)butanamide?
The IUPAC name of 2-(2-methoxyethoxy)butanamide (CID 62900293) is 2-(2-methoxyethoxy)butanamide.
What is the SMILES notation for 2-(2-methoxyethoxy)butanamide?
The canonical SMILES for 2-(2-methoxyethoxy)butanamide is CCC(OCCOC)C(N)=O.
What is the InChIKey of 2-(2-methoxyethoxy)butanamide?
The InChIKey is YMMOWDYMLYZCLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3/c1-3-6(7(8)9)11-5-4-10-2/h6H,3-5H2,1-2H3,(H2,8,9).
What are the key properties of 2-(2-methoxyethoxy)butanamide?
2-(2-methoxyethoxy)butanamide has a molecular weight of 161.20 g/mol, XLogP of -0.09, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)butanamide is sourced from PubChem (CID 62900293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).