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

C11H18N2O2 — CID 86262341

IUPAC4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one
SMILESCCNCCOc1cc(C)n(C)c(=O)c1
InChIInChI=1S/C11H18N2O2/c1-4-12-5-6-15-10-7-9(2)13(3)11(14)8-10/h7-8,12H,4-6H2,1-3H3
InChIKeyNFOMOHHFIWFSMP-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.68
Rot. Bonds5

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

4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one (PubChem CID 86262341) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one.

Molecular Properties

Compound Name4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one
PubChem CID86262341
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one
SMILESCCNCCOc1cc(C)n(C)c(=O)c1
InChIInChI=1S/C11H18N2O2/c1-4-12-5-6-15-10-7-9(2)13(3)11(14)8-10/h7-8,12H,4-6H2,1-3H3
InChIKeyNFOMOHHFIWFSMP-UHFFFAOYSA-N
XLogP0.68
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.68
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?
The IUPAC name of 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one (CID 86262341) is 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one.
What is the SMILES notation for 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one?
The canonical SMILES for 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one is CCNCCOc1cc(C)n(C)c(=O)c1.
What is the InChIKey of 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one?
The InChIKey is NFOMOHHFIWFSMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-4-12-5-6-15-10-7-9(2)13(3)11(14)8-10/h7-8,12H,4-6H2,1-3H3.
What are the key properties of 4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one?
4-[2-(ethylamino)ethoxy]-1,6-dimethylpyridin-2-one has a molecular weight of 210.28 g/mol, XLogP of 0.68, 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 is sourced from PubChem (CID 86262341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).