N-hydroxy-N-methoxypyrazine-2-carboxamide

C6H7N3O3 — CID 54209854

IUPACN-hydroxy-N-methoxypyrazine-2-carboxamide
SMILESCON(O)C(=O)c1cnccn1
InChIInChI=1S/C6H7N3O3/c1-12-9(11)6(10)5-4-7-2-3-8-5/h2-4,11H,1H3
InChIKeyPVELKPBLJNROPA-UHFFFAOYSA-N
MW169.14 g/mol
LogP-0.13
Rot. Bonds2

About N-hydroxy-N-methoxypyrazine-2-carboxamide

N-hydroxy-N-methoxypyrazine-2-carboxamide (PubChem CID 54209854) has the molecular formula C6H7N3O3 and a molecular weight of 169.14 g/mol. Its IUPAC name is N-hydroxy-N-methoxypyrazine-2-carboxamide.

Molecular Properties

Compound NameN-hydroxy-N-methoxypyrazine-2-carboxamide
PubChem CID54209854
Molecular FormulaC6H7N3O3
Molecular Weight169.14 g/mol
Exact Mass169.05
IUPAC NameN-hydroxy-N-methoxypyrazine-2-carboxamide
SMILESCON(O)C(=O)c1cnccn1
InChIInChI=1S/C6H7N3O3/c1-12-9(11)6(10)5-4-7-2-3-8-5/h2-4,11H,1H3
InChIKeyPVELKPBLJNROPA-UHFFFAOYSA-N
XLogP-0.13
TPSA75.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.14
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
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 N-hydroxy-N-methoxypyrazine-2-carboxamide?
The IUPAC name of N-hydroxy-N-methoxypyrazine-2-carboxamide (CID 54209854) is N-hydroxy-N-methoxypyrazine-2-carboxamide.
What is the SMILES notation for N-hydroxy-N-methoxypyrazine-2-carboxamide?
The canonical SMILES for N-hydroxy-N-methoxypyrazine-2-carboxamide is CON(O)C(=O)c1cnccn1.
What is the InChIKey of N-hydroxy-N-methoxypyrazine-2-carboxamide?
The InChIKey is PVELKPBLJNROPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O3/c1-12-9(11)6(10)5-4-7-2-3-8-5/h2-4,11H,1H3.
What are the key properties of N-hydroxy-N-methoxypyrazine-2-carboxamide?
N-hydroxy-N-methoxypyrazine-2-carboxamide has a molecular weight of 169.14 g/mol, XLogP of -0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-methoxypyrazine-2-carboxamide is sourced from PubChem (CID 54209854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).