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

C9H16N2O2 — CID 63106264

IUPAC2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)OC1CNC1
InChIInChI=1S/C9H16N2O2/c1-3-4-11-9(12)7(2)13-8-5-10-6-8/h3,7-8,10H,1,4-6H2,2H3,(H,11,12)
InChIKeyYEZWBNQFMLYGJI-UHFFFAOYSA-N
MW184.24 g/mol
LogP-0.33
Rot. Bonds5

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

2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide (PubChem CID 63106264) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide
PubChem CID63106264
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide
SMILESC=CCNC(=O)C(C)OC1CNC1
InChIInChI=1S/C9H16N2O2/c1-3-4-11-9(12)7(2)13-8-5-10-6-8/h3,7-8,10H,1,4-6H2,2H3,(H,11,12)
InChIKeyYEZWBNQFMLYGJI-UHFFFAOYSA-N
XLogP-0.33
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.33
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-enylpropanamide 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-enylpropanamide?
The IUPAC name of 2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide (CID 63106264) is 2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide.
What is the SMILES notation for 2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide?
The canonical SMILES for 2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide is C=CCNC(=O)C(C)OC1CNC1.
What is the InChIKey of 2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide?
The InChIKey is YEZWBNQFMLYGJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-3-4-11-9(12)7(2)13-8-5-10-6-8/h3,7-8,10H,1,4-6H2,2H3,(H,11,12).
What are the key properties of 2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide?
2-(azetidin-3-yloxy)-N-prop-2-enylpropanamide has a molecular weight of 184.24 g/mol, XLogP of -0.33, 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-enylpropanamide is sourced from PubChem (CID 63106264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).