2-(azetidin-3-yloxy)-N-prop-2-enylacetamide

C8H14N2O2 — CID 63104583

IUPAC2-(azetidin-3-yloxy)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)COC1CNC1
InChIInChI=1S/C8H14N2O2/c1-2-3-10-8(11)6-12-7-4-9-5-7/h2,7,9H,1,3-6H2,(H,10,11)
InChIKeyRPDQOCWZODUTMX-UHFFFAOYSA-N
MW170.21 g/mol
LogP-0.72
Rot. Bonds5

About 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide

2-(azetidin-3-yloxy)-N-prop-2-enylacetamide (PubChem CID 63104583) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-(azetidin-3-yloxy)-N-prop-2-enylacetamide
PubChem CID63104583
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name2-(azetidin-3-yloxy)-N-prop-2-enylacetamide
SMILESC=CCNC(=O)COC1CNC1
InChIInChI=1S/C8H14N2O2/c1-2-3-10-8(11)6-12-7-4-9-5-7/h2,7,9H,1,3-6H2,(H,10,11)
InChIKeyRPDQOCWZODUTMX-UHFFFAOYSA-N
XLogP-0.72
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide?
The IUPAC name of 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide (CID 63104583) is 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide.
What is the SMILES notation for 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide?
The canonical SMILES for 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide is C=CCNC(=O)COC1CNC1.
What is the InChIKey of 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide?
The InChIKey is RPDQOCWZODUTMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-2-3-10-8(11)6-12-7-4-9-5-7/h2,7,9H,1,3-6H2,(H,10,11).
What are the key properties of 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide?
2-(azetidin-3-yloxy)-N-prop-2-enylacetamide has a molecular weight of 170.21 g/mol, XLogP of -0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yloxy)-N-prop-2-enylacetamide is sourced from PubChem (CID 63104583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).