1-[2-(1-aminoethoxy)ethenoxy]ethanamine

C6H14N2O2 — CID 90876183

IUPAC1-[2-(1-aminoethoxy)ethenoxy]ethanamine
SMILESCC(N)OC=COC(C)N
InChIInChI=1S/C6H14N2O2/c1-5(7)9-3-4-10-6(2)8/h3-6H,7-8H2,1-2H3
InChIKeyHLUAYXWBEXQDJR-UHFFFAOYSA-N
MW146.19 g/mol
LogP0.10
Rot. Bonds4

About 1-[2-(1-aminoethoxy)ethenoxy]ethanamine

1-[2-(1-aminoethoxy)ethenoxy]ethanamine (PubChem CID 90876183) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 1-[2-(1-aminoethoxy)ethenoxy]ethanamine.

Molecular Properties

Compound Name1-[2-(1-aminoethoxy)ethenoxy]ethanamine
PubChem CID90876183
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC Name1-[2-(1-aminoethoxy)ethenoxy]ethanamine
SMILESCC(N)OC=COC(C)N
InChIInChI=1S/C6H14N2O2/c1-5(7)9-3-4-10-6(2)8/h3-6H,7-8H2,1-2H3
InChIKeyHLUAYXWBEXQDJR-UHFFFAOYSA-N
XLogP0.10
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-aminoethoxy)ethenoxy]ethanamine?
The IUPAC name of 1-[2-(1-aminoethoxy)ethenoxy]ethanamine (CID 90876183) is 1-[2-(1-aminoethoxy)ethenoxy]ethanamine.
What is the SMILES notation for 1-[2-(1-aminoethoxy)ethenoxy]ethanamine?
The canonical SMILES for 1-[2-(1-aminoethoxy)ethenoxy]ethanamine is CC(N)OC=COC(C)N.
What is the InChIKey of 1-[2-(1-aminoethoxy)ethenoxy]ethanamine?
The InChIKey is HLUAYXWBEXQDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-5(7)9-3-4-10-6(2)8/h3-6H,7-8H2,1-2H3.
What are the key properties of 1-[2-(1-aminoethoxy)ethenoxy]ethanamine?
1-[2-(1-aminoethoxy)ethenoxy]ethanamine has a molecular weight of 146.19 g/mol, XLogP of 0.10, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-aminoethoxy)ethenoxy]ethanamine is sourced from PubChem (CID 90876183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).