1,4-dihydropyrazine-2-carboxamide

C5H7N3O — CID 52944544

IUPAC1,4-dihydropyrazine-2-carboxamide
SMILESNC(=O)C1=CNC=CN1
InChIInChI=1S/C5H7N3O/c6-5(9)4-3-7-1-2-8-4/h1-3,7-8H,(H2,6,9)
InChIKeyJXKXVCWNNNROQH-UHFFFAOYSA-N
MW125.13 g/mol
LogP-1.02
Rot. Bonds1

About 1,4-dihydropyrazine-2-carboxamide

1,4-dihydropyrazine-2-carboxamide (PubChem CID 52944544) has the molecular formula C5H7N3O and a molecular weight of 125.13 g/mol. Its IUPAC name is 1,4-dihydropyrazine-2-carboxamide.

Molecular Properties

Compound Name1,4-dihydropyrazine-2-carboxamide
PubChem CID52944544
Molecular FormulaC5H7N3O
Molecular Weight125.13 g/mol
Exact Mass125.06
IUPAC Name1,4-dihydropyrazine-2-carboxamide
SMILESNC(=O)C1=CNC=CN1
InChIInChI=1S/C5H7N3O/c6-5(9)4-3-7-1-2-8-4/h1-3,7-8H,(H2,6,9)
InChIKeyJXKXVCWNNNROQH-UHFFFAOYSA-N
XLogP-1.02
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.13
LogP ≤ 5-1.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 1,4-dihydropyrazine-2-carboxamide 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 1,4-dihydropyrazine-2-carboxamide?
The IUPAC name of 1,4-dihydropyrazine-2-carboxamide (CID 52944544) is 1,4-dihydropyrazine-2-carboxamide.
What is the SMILES notation for 1,4-dihydropyrazine-2-carboxamide?
The canonical SMILES for 1,4-dihydropyrazine-2-carboxamide is NC(=O)C1=CNC=CN1.
What is the InChIKey of 1,4-dihydropyrazine-2-carboxamide?
The InChIKey is JXKXVCWNNNROQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O/c6-5(9)4-3-7-1-2-8-4/h1-3,7-8H,(H2,6,9).
What are the key properties of 1,4-dihydropyrazine-2-carboxamide?
1,4-dihydropyrazine-2-carboxamide has a molecular weight of 125.13 g/mol, XLogP of -1.02, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dihydropyrazine-2-carboxamide is sourced from PubChem (CID 52944544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).