2-[2-(methylamino)ethoxy]ethanol

C5H13NO2 — CID 15514970

IUPAC2-[2-(methylamino)ethoxy]ethanol
SMILESCNCCOCCO
InChIInChI=1S/C5H13NO2/c1-6-2-4-8-5-3-7/h6-7H,2-5H2,1H3
InChIKeyIPKWSCDDLHLVMC-UHFFFAOYSA-N
MW119.16 g/mol
LogP-0.79
Rot. Bonds5

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

2-[2-(methylamino)ethoxy]ethanol (PubChem CID 15514970) has the molecular formula C5H13NO2 and a molecular weight of 119.16 g/mol. Its IUPAC name is 2-[2-(methylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(methylamino)ethoxy]ethanol
PubChem CID15514970
Molecular FormulaC5H13NO2
Molecular Weight119.16 g/mol
Exact Mass119.09
IUPAC Name2-[2-(methylamino)ethoxy]ethanol
SMILESCNCCOCCO
InChIInChI=1S/C5H13NO2/c1-6-2-4-8-5-3-7/h6-7H,2-5H2,1H3
InChIKeyIPKWSCDDLHLVMC-UHFFFAOYSA-N
XLogP-0.79
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.16
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-(methylamino)ethoxy]ethanol?
The IUPAC name of 2-[2-(methylamino)ethoxy]ethanol (CID 15514970) is 2-[2-(methylamino)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(methylamino)ethoxy]ethanol?
The canonical SMILES for 2-[2-(methylamino)ethoxy]ethanol is CNCCOCCO.
What is the InChIKey of 2-[2-(methylamino)ethoxy]ethanol?
The InChIKey is IPKWSCDDLHLVMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13NO2/c1-6-2-4-8-5-3-7/h6-7H,2-5H2,1H3.
What are the key properties of 2-[2-(methylamino)ethoxy]ethanol?
2-[2-(methylamino)ethoxy]ethanol has a molecular weight of 119.16 g/mol, XLogP of -0.79, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)ethoxy]ethanol is sourced from PubChem (CID 15514970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).