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

C9H18N2O2 — CID 156559149

IUPAC2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide
SMILESCOCC(=O)N(C)CC1CN(C)C1
InChIInChI=1S/C9H18N2O2/c1-10-4-8(5-10)6-11(2)9(12)7-13-3/h8H,4-7H2,1-3H3
InChIKeyKARCHVWMRJLXGV-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.35
Rot. Bonds4

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

2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide (PubChem CID 156559149) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide
PubChem CID156559149
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide
SMILESCOCC(=O)N(C)CC1CN(C)C1
InChIInChI=1S/C9H18N2O2/c1-10-4-8(5-10)6-11(2)9(12)7-13-3/h8H,4-7H2,1-3H3
InChIKeyKARCHVWMRJLXGV-UHFFFAOYSA-N
XLogP-0.35
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide?
The IUPAC name of 2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide (CID 156559149) is 2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide.
What is the SMILES notation for 2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide?
The canonical SMILES for 2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide is COCC(=O)N(C)CC1CN(C)C1.
What is the InChIKey of 2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide?
The InChIKey is KARCHVWMRJLXGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-10-4-8(5-10)6-11(2)9(12)7-13-3/h8H,4-7H2,1-3H3.
What are the key properties of 2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide?
2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide has a molecular weight of 186.25 g/mol, XLogP of -0.35, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-N-[(1-methylazetidin-3-yl)methyl]acetamide is sourced from PubChem (CID 156559149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).