N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide

C11H20N2O2 — CID 102611508

IUPACN-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide
SMILESC=CCN(CC)C(=O)COC1(C)CNC1
InChIInChI=1S/C11H20N2O2/c1-4-6-13(5-2)10(14)7-15-11(3)8-12-9-11/h4,12H,1,5-9H2,2-3H3
InChIKeyNDMONZYLXRCRFM-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.40
Rot. Bonds6

About N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide

N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide (PubChem CID 102611508) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide.

Molecular Properties

Compound NameN-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide
PubChem CID102611508
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide
SMILESC=CCN(CC)C(=O)COC1(C)CNC1
InChIInChI=1S/C11H20N2O2/c1-4-6-13(5-2)10(14)7-15-11(3)8-12-9-11/h4,12H,1,5-9H2,2-3H3
InChIKeyNDMONZYLXRCRFM-UHFFFAOYSA-N
XLogP0.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(2-methylpropan-2-yl)oxy]-N-prop-2-enylacetamide
CID 60007900
2-ethoxy-2-methyl-N,N-bis(prop-2-enyl)propanamide
CID 146490139
2-ethoxy-2-methyl-N-prop-2-enylpropanamide
CID 178010544
N-[(E)-but-2-enyl]-2-ethoxy-2-methylpropanamide
CID 178011544
N-prop-2-enyl-2-[2-(propylamino)ethoxy]acetamide
CID 62335937
2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylpropanamide
CID 62336264
2-[2-(ethylamino)ethoxy]-N-prop-2-enylacetamide
CID 62336487
2-[2-(methylamino)ethoxy]-N-prop-2-enylpropanamide
CID 62336988
N-prop-2-enyl-2-[2-(propylamino)ethoxy]propanamide
CID 62337052
2-[2-(ethylamino)ethoxy]-N-prop-2-enylpropanamide
CID 62338219
2-[2-(methylamino)ethoxy]-N-prop-2-enylacetamide
CID 62338375
2-[1-(methylamino)propan-2-yloxy]-N-prop-2-enylacetamide
CID 62338387

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide?
The IUPAC name of N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide (CID 102611508) is N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide.
What is the SMILES notation for N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide?
The canonical SMILES for N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide is C=CCN(CC)C(=O)COC1(C)CNC1.
What is the InChIKey of N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide?
The InChIKey is NDMONZYLXRCRFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-4-6-13(5-2)10(14)7-15-11(3)8-12-9-11/h4,12H,1,5-9H2,2-3H3.
What are the key properties of N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide?
N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide has a molecular weight of 212.29 g/mol, XLogP of 0.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-methylazetidin-3-yl)oxy-N-prop-2-enylacetamide is sourced from PubChem (CID 102611508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).