3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one

C10H16N2O2 — CID 82064665

IUPAC3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one
SMILESCc1[nH]ccc(=O)c1OCCN(C)C
InChIInChI=1S/C10H16N2O2/c1-8-10(9(13)4-5-11-8)14-7-6-12(2)3/h4-5H,6-7H2,1-3H3,(H,11,13)
InChIKeyPDMWXMKDAODPDD-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.62
Rot. Bonds4

About 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one

3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one (PubChem CID 82064665) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one.

Molecular Properties

Compound Name3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one
PubChem CID82064665
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one
SMILESCc1[nH]ccc(=O)c1OCCN(C)C
InChIInChI=1S/C10H16N2O2/c1-8-10(9(13)4-5-11-8)14-7-6-12(2)3/h4-5H,6-7H2,1-3H3,(H,11,13)
InChIKeyPDMWXMKDAODPDD-UHFFFAOYSA-N
XLogP0.62
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one?
The IUPAC name of 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one (CID 82064665) is 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one.
What is the SMILES notation for 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one?
The canonical SMILES for 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one is Cc1[nH]ccc(=O)c1OCCN(C)C.
What is the InChIKey of 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one?
The InChIKey is PDMWXMKDAODPDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-8-10(9(13)4-5-11-8)14-7-6-12(2)3/h4-5H,6-7H2,1-3H3,(H,11,13).
What are the key properties of 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one?
3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one has a molecular weight of 196.25 g/mol, XLogP of 0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)ethoxy]-2-methyl-1H-pyridin-4-one is sourced from PubChem (CID 82064665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).