4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride

C11H19ClN2O2 — CID 86262340

IUPAC4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride
SMILESCCNCCOc1cc(C)n(C)c(=O)c1.Cl
InChIInChI=1S/C11H18N2O2.ClH/c1-4-12-5-6-15-10-7-9(2)13(3)11(14)8-10;/h7-8,12H,4-6H2,1-3H3;1H
InChIKeyJEEVORDTBUFFOI-UHFFFAOYSA-N
MW246.74 g/mol
LogP1.10
Rot. Bonds5

About 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride

4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride (PubChem CID 86262340) has the molecular formula C11H19ClN2O2 and a molecular weight of 246.74 g/mol. Its IUPAC name is 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride.

Molecular Properties

Compound Name4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride
PubChem CID86262340
Molecular FormulaC11H19ClN2O2
Molecular Weight246.74 g/mol
Exact Mass246.11
IUPAC Name4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride
SMILESCCNCCOc1cc(C)n(C)c(=O)c1.Cl
InChIInChI=1S/C11H18N2O2.ClH/c1-4-12-5-6-15-10-7-9(2)13(3)11(14)8-10;/h7-8,12H,4-6H2,1-3H3;1H
InChIKeyJEEVORDTBUFFOI-UHFFFAOYSA-N
XLogP1.10
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 51.10
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 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride?
The IUPAC name of 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride (CID 86262340) is 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride.
What is the SMILES notation for 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride?
The canonical SMILES for 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride is CCNCCOc1cc(C)n(C)c(=O)c1.Cl.
What is the InChIKey of 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride?
The InChIKey is JEEVORDTBUFFOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2.ClH/c1-4-12-5-6-15-10-7-9(2)13(3)11(14)8-10;/h7-8,12H,4-6H2,1-3H3;1H.
What are the key properties of 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride?
4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride has a molecular weight of 246.74 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one;hydrochloride is sourced from PubChem (CID 86262340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).