N-ethyl-2-prop-1-enoxyacetamide

C₇H₁₃NO₂ — CID 123332753

About N-ethyl-2-prop-1-enoxyacetamide

N-ethyl-2-prop-1-enoxyacetamide (PubChem CID 123332753) has the molecular formula C₇H₁₃NO₂ and a molecular weight of 143.19 g/mol. Its IUPAC name is N-ethyl-2-prop-1-enoxyacetamide.

Molecular Properties

• Compound Name: N-ethyl-2-prop-1-enoxyacetamide
• PubChem CID: 123332753
• Molecular Formula: C₇H₁₃NO₂
• Molecular Weight: 143.19 g/mol
• Exact Mass: 143.09
• IUPAC Name: N-ethyl-2-prop-1-enoxyacetamide
• SMILES: CC=COCC(=O)NCC
• InChI: InChI=1S/C7H13NO2/c1-3-5-10-6-7(9)8-4-2/h3,5H,4,6H2,1-2H3,(H,8,9)
• InChIKey: ODXHPFPCKSCODN-UHFFFAOYSA-N
• XLogP: 0.67
• TPSA: 38.33 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 4
• Heavy Atoms: 10
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	143.19
LogP ≤ 5	0.67
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-prop-1-enoxyacetamide?

The IUPAC name of N-ethyl-2-prop-1-enoxyacetamide (CID 123332753) is N-ethyl-2-prop-1-enoxyacetamide.

What is the SMILES notation for N-ethyl-2-prop-1-enoxyacetamide?

The canonical SMILES for N-ethyl-2-prop-1-enoxyacetamide is CC=COCC(=O)NCC.

What is the InChIKey of N-ethyl-2-prop-1-enoxyacetamide?

The InChIKey is ODXHPFPCKSCODN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-3-5-10-6-7(9)8-4-2/h3,5H,4,6H2,1-2H3,(H,8,9).

What are the key properties of N-ethyl-2-prop-1-enoxyacetamide?

N-ethyl-2-prop-1-enoxyacetamide has a molecular weight of 143.19 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-ethyl-2-prop-1-enoxyacetamide is sourced from PubChem (CID 123332753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 123332753 — identifiers, structure, computed properties (public domain)

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