1-[1-(dimethylamino)ethoxy]ethanol

C6H15NO2 — CID 20544002

IUPAC1-[1-(dimethylamino)ethoxy]ethanol
SMILESCC(O)OC(C)N(C)C
InChIInChI=1S/C6H15NO2/c1-5(7(3)4)9-6(2)8/h5-6,8H,1-4H3
InChIKeyHOWAHBOFCDMFEA-UHFFFAOYSA-N
MW133.19 g/mol
LogP0.25
Rot. Bonds3

About 1-[1-(dimethylamino)ethoxy]ethanol

1-[1-(dimethylamino)ethoxy]ethanol (PubChem CID 20544002) has the molecular formula C6H15NO2 and a molecular weight of 133.19 g/mol. Its IUPAC name is 1-[1-(dimethylamino)ethoxy]ethanol.

Molecular Properties

Compound Name1-[1-(dimethylamino)ethoxy]ethanol
PubChem CID20544002
Molecular FormulaC6H15NO2
Molecular Weight133.19 g/mol
Exact Mass133.11
IUPAC Name1-[1-(dimethylamino)ethoxy]ethanol
SMILESCC(O)OC(C)N(C)C
InChIInChI=1S/C6H15NO2/c1-5(7(3)4)9-6(2)8/h5-6,8H,1-4H3
InChIKeyHOWAHBOFCDMFEA-UHFFFAOYSA-N
XLogP0.25
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.19
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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-[1-(dimethylamino)ethoxy]ethanol?
The IUPAC name of 1-[1-(dimethylamino)ethoxy]ethanol (CID 20544002) is 1-[1-(dimethylamino)ethoxy]ethanol.
What is the SMILES notation for 1-[1-(dimethylamino)ethoxy]ethanol?
The canonical SMILES for 1-[1-(dimethylamino)ethoxy]ethanol is CC(O)OC(C)N(C)C.
What is the InChIKey of 1-[1-(dimethylamino)ethoxy]ethanol?
The InChIKey is HOWAHBOFCDMFEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NO2/c1-5(7(3)4)9-6(2)8/h5-6,8H,1-4H3.
What are the key properties of 1-[1-(dimethylamino)ethoxy]ethanol?
1-[1-(dimethylamino)ethoxy]ethanol has a molecular weight of 133.19 g/mol, XLogP of 0.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(dimethylamino)ethoxy]ethanol is sourced from PubChem (CID 20544002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).