2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide

C8H16N2O2 — CID 156559162

IUPAC2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide
SMILESCOCC(=O)NCC1CN(C)C1
InChIInChI=1S/C8H16N2O2/c1-10-4-7(5-10)3-9-8(11)6-12-2/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyNDXYAIYZGASSHK-UHFFFAOYSA-N
MW172.23 g/mol
LogP-0.69
Rot. Bonds4

About 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide

2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide (PubChem CID 156559162) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide
PubChem CID156559162
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC Name2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide
SMILESCOCC(=O)NCC1CN(C)C1
InChIInChI=1S/C8H16N2O2/c1-10-4-7(5-10)3-9-8(11)6-12-2/h7H,3-6H2,1-2H3,(H,9,11)
InChIKeyNDXYAIYZGASSHK-UHFFFAOYSA-N
XLogP-0.69
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 5-0.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide?
The IUPAC name of 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide (CID 156559162) is 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide?
The canonical SMILES for 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide is COCC(=O)NCC1CN(C)C1.
What is the InChIKey of 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide?
The InChIKey is NDXYAIYZGASSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-10-4-7(5-10)3-9-8(11)6-12-2/h7H,3-6H2,1-2H3,(H,9,11).
What are the key properties of 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide?
2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide has a molecular weight of 172.23 g/mol, XLogP of -0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(1-methylazetidin-3-yl)methyl]acetamide is sourced from PubChem (CID 156559162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).