2-hydroxy-3-pyrazin-2-ylprop-2-enamide

C7H7N3O2 — CID 149253820

IUPAC2-hydroxy-3-pyrazin-2-ylprop-2-enamide
SMILESNC(=O)C(O)=Cc1cnccn1
InChIInChI=1S/C7H7N3O2/c8-7(12)6(11)3-5-4-9-1-2-10-5/h1-4,11H,(H2,8,12)
InChIKeyHUKHGAPPHSYESC-UHFFFAOYSA-N
MW165.15 g/mol
LogP-0.14
Rot. Bonds2

About 2-hydroxy-3-pyrazin-2-ylprop-2-enamide

2-hydroxy-3-pyrazin-2-ylprop-2-enamide (PubChem CID 149253820) has the molecular formula C7H7N3O2 and a molecular weight of 165.15 g/mol. Its IUPAC name is 2-hydroxy-3-pyrazin-2-ylprop-2-enamide.

Molecular Properties

Compound Name2-hydroxy-3-pyrazin-2-ylprop-2-enamide
PubChem CID149253820
Molecular FormulaC7H7N3O2
Molecular Weight165.15 g/mol
Exact Mass165.05
IUPAC Name2-hydroxy-3-pyrazin-2-ylprop-2-enamide
SMILESNC(=O)C(O)=Cc1cnccn1
InChIInChI=1S/C7H7N3O2/c8-7(12)6(11)3-5-4-9-1-2-10-5/h1-4,11H,(H2,8,12)
InChIKeyHUKHGAPPHSYESC-UHFFFAOYSA-N
XLogP-0.14
TPSA89.10 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-pyrazin-2-ylprop-2-enamide?
The IUPAC name of 2-hydroxy-3-pyrazin-2-ylprop-2-enamide (CID 149253820) is 2-hydroxy-3-pyrazin-2-ylprop-2-enamide.
What is the SMILES notation for 2-hydroxy-3-pyrazin-2-ylprop-2-enamide?
The canonical SMILES for 2-hydroxy-3-pyrazin-2-ylprop-2-enamide is NC(=O)C(O)=Cc1cnccn1.
What is the InChIKey of 2-hydroxy-3-pyrazin-2-ylprop-2-enamide?
The InChIKey is HUKHGAPPHSYESC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2/c8-7(12)6(11)3-5-4-9-1-2-10-5/h1-4,11H,(H2,8,12).
What are the key properties of 2-hydroxy-3-pyrazin-2-ylprop-2-enamide?
2-hydroxy-3-pyrazin-2-ylprop-2-enamide has a molecular weight of 165.15 g/mol, XLogP of -0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-pyrazin-2-ylprop-2-enamide is sourced from PubChem (CID 149253820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).