N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide

C9H16F2N2O2 — CID 102611521

IUPACN-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCN(CC(F)F)C(=O)COC1(C)CNC1
InChIInChI=1S/C9H16F2N2O2/c1-9(5-12-6-9)15-4-8(14)13(2)3-7(10)11/h7,12H,3-6H2,1-2H3
InChIKeyRJHCZYYYUGVEEW-UHFFFAOYSA-N
MW222.23 g/mol
LogP0.09
Rot. Bonds5

About N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide

N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide (PubChem CID 102611521) has the molecular formula C9H16F2N2O2 and a molecular weight of 222.23 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide
PubChem CID102611521
Molecular FormulaC9H16F2N2O2
Molecular Weight222.23 g/mol
Exact Mass222.12
IUPAC NameN-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide
SMILESCN(CC(F)F)C(=O)COC1(C)CNC1
InChIInChI=1S/C9H16F2N2O2/c1-9(5-12-6-9)15-4-8(14)13(2)3-7(10)11/h7,12H,3-6H2,1-2H3
InChIKeyRJHCZYYYUGVEEW-UHFFFAOYSA-N
XLogP0.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.23
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide?
The IUPAC name of N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide (CID 102611521) is N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide.
What is the SMILES notation for N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide?
The canonical SMILES for N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide is CN(CC(F)F)C(=O)COC1(C)CNC1.
What is the InChIKey of N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide?
The InChIKey is RJHCZYYYUGVEEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F2N2O2/c1-9(5-12-6-9)15-4-8(14)13(2)3-7(10)11/h7,12H,3-6H2,1-2H3.
What are the key properties of N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide?
N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide has a molecular weight of 222.23 g/mol, XLogP of 0.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide is sourced from PubChem (CID 102611521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).