2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide

C9H12N2O4 — CID 16853138

IUPAC2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide
SMILESCOc1cn(CC(N)=O)c(CO)cc1=O
InChIInChI=1S/C9H12N2O4/c1-15-8-3-11(4-9(10)14)6(5-12)2-7(8)13/h2-3,12H,4-5H2,1H3,(H2,10,14)
InChIKeyDUFCTJPNPLXIQP-UHFFFAOYSA-N
MW212.21 g/mol
LogP-1.17
Rot. Bonds4

About 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide

2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide (PubChem CID 16853138) has the molecular formula C9H12N2O4 and a molecular weight of 212.21 g/mol. Its IUPAC name is 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide.

Molecular Properties

Compound Name2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide
PubChem CID16853138
Molecular FormulaC9H12N2O4
Molecular Weight212.21 g/mol
Exact Mass212.08
IUPAC Name2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide
SMILESCOc1cn(CC(N)=O)c(CO)cc1=O
InChIInChI=1S/C9H12N2O4/c1-15-8-3-11(4-9(10)14)6(5-12)2-7(8)13/h2-3,12H,4-5H2,1H3,(H2,10,14)
InChIKeyDUFCTJPNPLXIQP-UHFFFAOYSA-N
XLogP-1.17
TPSA94.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.21
LogP ≤ 5-1.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide 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 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide?
The IUPAC name of 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide (CID 16853138) is 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide.
What is the SMILES notation for 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide?
The canonical SMILES for 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide is COc1cn(CC(N)=O)c(CO)cc1=O.
What is the InChIKey of 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide?
The InChIKey is DUFCTJPNPLXIQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O4/c1-15-8-3-11(4-9(10)14)6(5-12)2-7(8)13/h2-3,12H,4-5H2,1H3,(H2,10,14).
What are the key properties of 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide?
2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide has a molecular weight of 212.21 g/mol, XLogP of -1.17, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(hydroxymethyl)-5-methoxy-4-oxo-1-pyridinyl]acetamide is sourced from PubChem (CID 16853138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).