2-ethyl-4-methoxybutanamide

C7H15NO2 — CID 55290162

IUPAC2-ethyl-4-methoxybutanamide
SMILESCCC(CCOC)C(N)=O
InChIInChI=1S/C7H15NO2/c1-3-6(7(8)9)4-5-10-2/h6H,3-5H2,1-2H3,(H2,8,9)
InChIKeyVMGUXLFFWSNEHR-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.53
Rot. Bonds5

About 2-ethyl-4-methoxybutanamide

2-ethyl-4-methoxybutanamide (PubChem CID 55290162) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 2-ethyl-4-methoxybutanamide.

Molecular Properties

Compound Name2-ethyl-4-methoxybutanamide
PubChem CID55290162
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name2-ethyl-4-methoxybutanamide
SMILESCCC(CCOC)C(N)=O
InChIInChI=1S/C7H15NO2/c1-3-6(7(8)9)4-5-10-2/h6H,3-5H2,1-2H3,(H2,8,9)
InChIKeyVMGUXLFFWSNEHR-UHFFFAOYSA-N
XLogP0.53
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Oxane-4-carboxamide
CID 13197203
4-ethoxy-N-fluoro-2-methylbutanamide
CID 59319960
N-fluoro-4-methoxy-2-methylbutanamide
CID 59324300
4-Methoxy-2-methylbutanamide
CID 17911000
4-Methoxy-3-methylbutanamide
CID 18430298
2-Ethyl-4-hydroxybutanamide
CID 22244879
4-Methoxy-2-(2-methoxyethyl)butanamide
CID 23087119
5-Methoxy-3-methylpentanamide
CID 55284162
(3S,4R)-3-methyl-tetrahydro-pyran-4-carboxylic acid amide
CID 55289009
2-(Oxetan-3-yl)acetamide
CID 67125854
Oxane-4-carboxamide;hydrochloride
CID 68867617
3-Methyloxane-4-carboxamide
CID 76224325

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methoxybutanamide?
The IUPAC name of 2-ethyl-4-methoxybutanamide (CID 55290162) is 2-ethyl-4-methoxybutanamide.
What is the SMILES notation for 2-ethyl-4-methoxybutanamide?
The canonical SMILES for 2-ethyl-4-methoxybutanamide is CCC(CCOC)C(N)=O.
What is the InChIKey of 2-ethyl-4-methoxybutanamide?
The InChIKey is VMGUXLFFWSNEHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-3-6(7(8)9)4-5-10-2/h6H,3-5H2,1-2H3,(H2,8,9).
What are the key properties of 2-ethyl-4-methoxybutanamide?
2-ethyl-4-methoxybutanamide has a molecular weight of 145.20 g/mol, XLogP of 0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methoxybutanamide is sourced from PubChem (CID 55290162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).