1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one

C11H18N2O2 — CID 24881318

IUPAC1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one
SMILESCCc1c(O)c(=O)ccn1CCN(C)C
InChIInChI=1S/C11H18N2O2/c1-4-9-11(15)10(14)5-6-13(9)8-7-12(2)3/h5-6,15H,4,7-8H2,1-3H3
InChIKeyHPTHSRIGMSQABM-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.68
Rot. Bonds4

About 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one

1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one (PubChem CID 24881318) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one.

Molecular Properties

Compound Name1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one
PubChem CID24881318
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one
SMILESCCc1c(O)c(=O)ccn1CCN(C)C
InChIInChI=1S/C11H18N2O2/c1-4-9-11(15)10(14)5-6-13(9)8-7-12(2)3/h5-6,15H,4,7-8H2,1-3H3
InChIKeyHPTHSRIGMSQABM-UHFFFAOYSA-N
XLogP0.68
TPSA45.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
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

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one?
The IUPAC name of 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one (CID 24881318) is 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one.
What is the SMILES notation for 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one?
The canonical SMILES for 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one is CCc1c(O)c(=O)ccn1CCN(C)C.
What is the InChIKey of 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one?
The InChIKey is HPTHSRIGMSQABM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-4-9-11(15)10(14)5-6-13(9)8-7-12(2)3/h5-6,15H,4,7-8H2,1-3H3.
What are the key properties of 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one?
1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one has a molecular weight of 210.28 g/mol, XLogP of 0.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(dimethylamino)ethyl]-2-ethyl-3-hydroxypyridin-4-one is sourced from PubChem (CID 24881318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).