2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine

C9H20N2O2 — CID 79479470

IUPAC2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine
SMILESCC1COCCN1CCOCCN
InChIInChI=1S/C9H20N2O2/c1-9-8-13-7-4-11(9)3-6-12-5-2-10/h9H,2-8,10H2,1H3
InChIKeyOQOLFYGVYJCPHF-UHFFFAOYSA-N
MW188.27 g/mol
LogP-0.32
Rot. Bonds5

About 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine

2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine (PubChem CID 79479470) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine.

Molecular Properties

Compound Name2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine
PubChem CID79479470
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine
SMILESCC1COCCN1CCOCCN
InChIInChI=1S/C9H20N2O2/c1-9-8-13-7-4-11(9)3-6-12-5-2-10/h9H,2-8,10H2,1H3
InChIKeyOQOLFYGVYJCPHF-UHFFFAOYSA-N
XLogP-0.32
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine?
The IUPAC name of 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine (CID 79479470) is 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine.
What is the SMILES notation for 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine?
The canonical SMILES for 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine is CC1COCCN1CCOCCN.
What is the InChIKey of 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine?
The InChIKey is OQOLFYGVYJCPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-9-8-13-7-4-11(9)3-6-12-5-2-10/h9H,2-8,10H2,1H3.
What are the key properties of 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine?
2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine has a molecular weight of 188.27 g/mol, XLogP of -0.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methylmorpholin-4-yl)ethoxy]ethanamine is sourced from PubChem (CID 79479470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).