(3-ethoxy-1-methylazetidin-3-yl)methanamine

C7H16N2O — CID 115011605

IUPAC(3-ethoxy-1-methylazetidin-3-yl)methanamine
SMILESCCOC1(CN)CN(C)C1
InChIInChI=1S/C7H16N2O/c1-3-10-7(4-8)5-9(2)6-7/h3-6,8H2,1-2H3
InChIKeyBLUVGIKEVGNZAE-UHFFFAOYSA-N
MW144.22 g/mol
LogP-0.33
Rot. Bonds3

About (3-ethoxy-1-methylazetidin-3-yl)methanamine

(3-ethoxy-1-methylazetidin-3-yl)methanamine (PubChem CID 115011605) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is (3-ethoxy-1-methylazetidin-3-yl)methanamine.

Molecular Properties

Compound Name(3-ethoxy-1-methylazetidin-3-yl)methanamine
PubChem CID115011605
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name(3-ethoxy-1-methylazetidin-3-yl)methanamine
SMILESCCOC1(CN)CN(C)C1
InChIInChI=1S/C7H16N2O/c1-3-10-7(4-8)5-9(2)6-7/h3-6,8H2,1-2H3
InChIKeyBLUVGIKEVGNZAE-UHFFFAOYSA-N
XLogP-0.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-ethoxy-1-methylazetidin-3-yl)methanamine?
The IUPAC name of (3-ethoxy-1-methylazetidin-3-yl)methanamine (CID 115011605) is (3-ethoxy-1-methylazetidin-3-yl)methanamine.
What is the SMILES notation for (3-ethoxy-1-methylazetidin-3-yl)methanamine?
The canonical SMILES for (3-ethoxy-1-methylazetidin-3-yl)methanamine is CCOC1(CN)CN(C)C1.
What is the InChIKey of (3-ethoxy-1-methylazetidin-3-yl)methanamine?
The InChIKey is BLUVGIKEVGNZAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-3-10-7(4-8)5-9(2)6-7/h3-6,8H2,1-2H3.
What are the key properties of (3-ethoxy-1-methylazetidin-3-yl)methanamine?
(3-ethoxy-1-methylazetidin-3-yl)methanamine has a molecular weight of 144.22 g/mol, XLogP of -0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxy-1-methylazetidin-3-yl)methanamine is sourced from PubChem (CID 115011605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).