2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol

C7H18N2O2 — CID 57117202

IUPAC2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol
SMILESCCNCCOC(CO)NC
InChIInChI=1S/C7H18N2O2/c1-3-9-4-5-11-7(6-10)8-2/h7-10H,3-6H2,1-2H3
InChIKeyXSLCUROXELPKCH-UHFFFAOYSA-N
MW162.23 g/mol
LogP-0.85
Rot. Bonds7

About 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol

2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol (PubChem CID 57117202) has the molecular formula C7H18N2O2 and a molecular weight of 162.23 g/mol. Its IUPAC name is 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol.

Molecular Properties

Compound Name2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol
PubChem CID57117202
Molecular FormulaC7H18N2O2
Molecular Weight162.23 g/mol
Exact Mass162.14
IUPAC Name2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol
SMILESCCNCCOC(CO)NC
InChIInChI=1S/C7H18N2O2/c1-3-9-4-5-11-7(6-10)8-2/h7-10H,3-6H2,1-2H3
InChIKeyXSLCUROXELPKCH-UHFFFAOYSA-N
XLogP-0.85
TPSA53.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 5-0.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol?
The IUPAC name of 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol (CID 57117202) is 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol.
What is the SMILES notation for 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol?
The canonical SMILES for 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol is CCNCCOC(CO)NC.
What is the InChIKey of 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol?
The InChIKey is XSLCUROXELPKCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O2/c1-3-9-4-5-11-7(6-10)8-2/h7-10H,3-6H2,1-2H3.
What are the key properties of 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol?
2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol has a molecular weight of 162.23 g/mol, XLogP of -0.85, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(ethylamino)ethoxy]-2-(methylamino)ethanol is sourced from PubChem (CID 57117202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).