3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide

C9H11N3O3 — CID 86150893

IUPAC3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide
SMILESNC(=O)c1ncccc1C(=O)NCCO
InChIInChI=1S/C9H11N3O3/c10-8(14)7-6(2-1-3-11-7)9(15)12-4-5-13/h1-3,13H,4-5H2,(H2,10,14)(H,12,15)
InChIKeyJJNRJGLIFCLYCH-UHFFFAOYSA-N
MW209.21 g/mol
LogP-1.10
Rot. Bonds4

About 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide

3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide (PubChem CID 86150893) has the molecular formula C9H11N3O3 and a molecular weight of 209.21 g/mol. Its IUPAC name is 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide.

Molecular Properties

Compound Name3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide
PubChem CID86150893
Molecular FormulaC9H11N3O3
Molecular Weight209.21 g/mol
Exact Mass209.08
IUPAC Name3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide
SMILESNC(=O)c1ncccc1C(=O)NCCO
InChIInChI=1S/C9H11N3O3/c10-8(14)7-6(2-1-3-11-7)9(15)12-4-5-13/h1-3,13H,4-5H2,(H2,10,14)(H,12,15)
InChIKeyJJNRJGLIFCLYCH-UHFFFAOYSA-N
XLogP-1.10
TPSA105.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.21
LogP ≤ 5-1.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide 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-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide?
The IUPAC name of 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide (CID 86150893) is 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide.
What is the SMILES notation for 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide?
The canonical SMILES for 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide is NC(=O)c1ncccc1C(=O)NCCO.
What is the InChIKey of 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide?
The InChIKey is JJNRJGLIFCLYCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3/c10-8(14)7-6(2-1-3-11-7)9(15)12-4-5-13/h1-3,13H,4-5H2,(H2,10,14)(H,12,15).
What are the key properties of 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide?
3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide has a molecular weight of 209.21 g/mol, XLogP of -1.10, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-hydroxyethyl)pyridine-2,3-dicarboxamide is sourced from PubChem (CID 86150893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).