5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide

C9H12N2O4 — CID 175442250

IUPAC5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide
SMILESCCOc1cnc(C(=O)NO)cc1OC
InChIInChI=1S/C9H12N2O4/c1-3-15-8-5-10-6(9(12)11-13)4-7(8)14-2/h4-5,13H,3H2,1-2H3,(H,11,12)
InChIKeyHEPGESMIIIKVAZ-UHFFFAOYSA-N
MW212.20 g/mol
LogP0.61
Rot. Bonds4

About 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide

5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide (PubChem CID 175442250) has the molecular formula C9H12N2O4 and a molecular weight of 212.20 g/mol. Its IUPAC name is 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide.

Molecular Properties

Compound Name5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide
PubChem CID175442250
Molecular FormulaC9H12N2O4
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC Name5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide
SMILESCCOc1cnc(C(=O)NO)cc1OC
InChIInChI=1S/C9H12N2O4/c1-3-15-8-5-10-6(9(12)11-13)4-7(8)14-2/h4-5,13H,3H2,1-2H3,(H,11,12)
InChIKeyHEPGESMIIIKVAZ-UHFFFAOYSA-N
XLogP0.61
TPSA80.68 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide?
The IUPAC name of 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide (CID 175442250) is 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide.
What is the SMILES notation for 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide?
The canonical SMILES for 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide is CCOc1cnc(C(=O)NO)cc1OC.
What is the InChIKey of 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide?
The InChIKey is HEPGESMIIIKVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O4/c1-3-15-8-5-10-6(9(12)11-13)4-7(8)14-2/h4-5,13H,3H2,1-2H3,(H,11,12).
What are the key properties of 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide?
5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide has a molecular weight of 212.20 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethoxy-N-hydroxy-4-methoxypyridine-2-carboxamide is sourced from PubChem (CID 175442250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).