2-methoxy-N-prop-2-enylacetamide

C6H11NO2 — CID 11355489

IUPAC2-methoxy-N-prop-2-enylacetamide
SMILESC=CCNC(=O)COC
InChIInChI=1S/C6H11NO2/c1-3-4-7-6(8)5-9-2/h3H,1,4-5H2,2H3,(H,7,8)
InChIKeyNEICLNQEQYIEGK-UHFFFAOYSA-N
MW129.16 g/mol
LogP-0.06
Rot. Bonds4

About 2-methoxy-N-prop-2-enylacetamide

2-methoxy-N-prop-2-enylacetamide (PubChem CID 11355489) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is 2-methoxy-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-methoxy-N-prop-2-enylacetamide
PubChem CID11355489
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name2-methoxy-N-prop-2-enylacetamide
SMILESC=CCNC(=O)COC
InChIInChI=1S/C6H11NO2/c1-3-4-7-6(8)5-9-2/h3H,1,4-5H2,2H3,(H,7,8)
InChIKeyNEICLNQEQYIEGK-UHFFFAOYSA-N
XLogP-0.06
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-prop-2-enylacetamide?
The IUPAC name of 2-methoxy-N-prop-2-enylacetamide (CID 11355489) is 2-methoxy-N-prop-2-enylacetamide.
What is the SMILES notation for 2-methoxy-N-prop-2-enylacetamide?
The canonical SMILES for 2-methoxy-N-prop-2-enylacetamide is C=CCNC(=O)COC.
What is the InChIKey of 2-methoxy-N-prop-2-enylacetamide?
The InChIKey is NEICLNQEQYIEGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-3-4-7-6(8)5-9-2/h3H,1,4-5H2,2H3,(H,7,8).
What are the key properties of 2-methoxy-N-prop-2-enylacetamide?
2-methoxy-N-prop-2-enylacetamide has a molecular weight of 129.16 g/mol, XLogP of -0.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-prop-2-enylacetamide is sourced from PubChem (CID 11355489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).