1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one

C10H15NO4 — CID 82150744

IUPAC1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one
SMILESO=c1c(OCCCO)cccn1CCO
InChIInChI=1S/C10H15NO4/c12-6-2-8-15-9-3-1-4-11(5-7-13)10(9)14/h1,3-4,12-13H,2,5-8H2
InChIKeyUUJOAFHXYBLOBB-UHFFFAOYSA-N
MW213.23 g/mol
LogP-0.40
Rot. Bonds6

About 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one

1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one (PubChem CID 82150744) has the molecular formula C10H15NO4 and a molecular weight of 213.23 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one
PubChem CID82150744
Molecular FormulaC10H15NO4
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one
SMILESO=c1c(OCCCO)cccn1CCO
InChIInChI=1S/C10H15NO4/c12-6-2-8-15-9-3-1-4-11(5-7-13)10(9)14/h1,3-4,12-13H,2,5-8H2
InChIKeyUUJOAFHXYBLOBB-UHFFFAOYSA-N
XLogP-0.40
TPSA71.69 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-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 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one?
The IUPAC name of 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one (CID 82150744) is 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one.
What is the SMILES notation for 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one?
The canonical SMILES for 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one is O=c1c(OCCCO)cccn1CCO.
What is the InChIKey of 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one?
The InChIKey is UUJOAFHXYBLOBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO4/c12-6-2-8-15-9-3-1-4-11(5-7-13)10(9)14/h1,3-4,12-13H,2,5-8H2.
What are the key properties of 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one?
1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one has a molecular weight of 213.23 g/mol, XLogP of -0.40, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-3-(3-hydroxypropoxy)pyridin-2-one is sourced from PubChem (CID 82150744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).