1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine

C8H18N2O — CID 168995973

IUPAC1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine
SMILESCCOC1(CNC)CN(C)C1
InChIInChI=1S/C8H18N2O/c1-4-11-8(5-9-2)6-10(3)7-8/h9H,4-7H2,1-3H3
InChIKeyRJZBQLAUWIQYJU-UHFFFAOYSA-N
MW158.24 g/mol
LogP-0.07
Rot. Bonds4

About 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine

1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine (PubChem CID 168995973) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine
PubChem CID168995973
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine
SMILESCCOC1(CNC)CN(C)C1
InChIInChI=1S/C8H18N2O/c1-4-11-8(5-9-2)6-10(3)7-8/h9H,4-7H2,1-3H3
InChIKeyRJZBQLAUWIQYJU-UHFFFAOYSA-N
XLogP-0.07
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine (CID 168995973) is 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine is CCOC1(CNC)CN(C)C1.
What is the InChIKey of 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine?
The InChIKey is RJZBQLAUWIQYJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-4-11-8(5-9-2)6-10(3)7-8/h9H,4-7H2,1-3H3.
What are the key properties of 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine?
1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine has a molecular weight of 158.24 g/mol, XLogP of -0.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxy-1-methylazetidin-3-yl)-N-methylmethanamine is sourced from PubChem (CID 168995973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).