2-(azetidin-3-yloxy)-N,N-diethylethanamine

C9H20N2O — CID 63105151

IUPAC2-(azetidin-3-yloxy)-N,N-diethylethanamine
SMILESCCN(CC)CCOC1CNC1
InChIInChI=1S/C9H20N2O/c1-3-11(4-2)5-6-12-9-7-10-8-9/h9-10H,3-8H2,1-2H3
InChIKeyREJPPJAGYJYICY-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.32
Rot. Bonds6

About 2-(azetidin-3-yloxy)-N,N-diethylethanamine

2-(azetidin-3-yloxy)-N,N-diethylethanamine (PubChem CID 63105151) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-(azetidin-3-yloxy)-N,N-diethylethanamine.

Molecular Properties

Compound Name2-(azetidin-3-yloxy)-N,N-diethylethanamine
PubChem CID63105151
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name2-(azetidin-3-yloxy)-N,N-diethylethanamine
SMILESCCN(CC)CCOC1CNC1
InChIInChI=1S/C9H20N2O/c1-3-11(4-2)5-6-12-9-7-10-8-9/h9-10H,3-8H2,1-2H3
InChIKeyREJPPJAGYJYICY-UHFFFAOYSA-N
XLogP0.32
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yloxy)-N,N-diethylethanamine?
The IUPAC name of 2-(azetidin-3-yloxy)-N,N-diethylethanamine (CID 63105151) is 2-(azetidin-3-yloxy)-N,N-diethylethanamine.
What is the SMILES notation for 2-(azetidin-3-yloxy)-N,N-diethylethanamine?
The canonical SMILES for 2-(azetidin-3-yloxy)-N,N-diethylethanamine is CCN(CC)CCOC1CNC1.
What is the InChIKey of 2-(azetidin-3-yloxy)-N,N-diethylethanamine?
The InChIKey is REJPPJAGYJYICY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-3-11(4-2)5-6-12-9-7-10-8-9/h9-10H,3-8H2,1-2H3.
What are the key properties of 2-(azetidin-3-yloxy)-N,N-diethylethanamine?
2-(azetidin-3-yloxy)-N,N-diethylethanamine has a molecular weight of 172.27 g/mol, XLogP of 0.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yloxy)-N,N-diethylethanamine is sourced from PubChem (CID 63105151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).