N-(2-methoxyethyl)propanamide

C6H13NO2 — CID 5151403

IUPACN-(2-methoxyethyl)propanamide
SMILESCCC(=O)NCCOC
InChIInChI=1S/C6H13NO2/c1-3-6(8)7-4-5-9-2/h3-5H2,1-2H3,(H,7,8)
InChIKeyCVKMCTKUFWPCBY-UHFFFAOYSA-N
MW131.18 g/mol
LogP0.16
Rot. Bonds4

About N-(2-methoxyethyl)propanamide

N-(2-methoxyethyl)propanamide (PubChem CID 5151403) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)propanamide
PubChem CID5151403
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC NameN-(2-methoxyethyl)propanamide
SMILESCCC(=O)NCCOC
InChIInChI=1S/C6H13NO2/c1-3-6(8)7-4-5-9-2/h3-5H2,1-2H3,(H,7,8)
InChIKeyCVKMCTKUFWPCBY-UHFFFAOYSA-N
XLogP0.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 N-(2-methoxyethyl)propanamide?
The IUPAC name of N-(2-methoxyethyl)propanamide (CID 5151403) is N-(2-methoxyethyl)propanamide.
What is the SMILES notation for N-(2-methoxyethyl)propanamide?
The canonical SMILES for N-(2-methoxyethyl)propanamide is CCC(=O)NCCOC.
What is the InChIKey of N-(2-methoxyethyl)propanamide?
The InChIKey is CVKMCTKUFWPCBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-3-6(8)7-4-5-9-2/h3-5H2,1-2H3,(H,7,8).
What are the key properties of N-(2-methoxyethyl)propanamide?
N-(2-methoxyethyl)propanamide has a molecular weight of 131.18 g/mol, XLogP of 0.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 5151403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).