2-(3-methylpyrazin-2-yl)ethanimidamide

C7H10N4 — CID 83676288

IUPAC2-(3-methylpyrazin-2-yl)ethanimidamide
SMILES[H]/N=C(\N)Cc1nccnc1C
InChIInChI=1S/C7H10N4/c1-5-6(4-7(8)9)11-3-2-10-5/h2-3H,4H2,1H3,(H3,8,9)
InChIKeyFKZKZNGAGUMWCD-UHFFFAOYSA-N
MW150.19 g/mol
LogP0.26
Rot. Bonds2

About 2-(3-methylpyrazin-2-yl)ethanimidamide

2-(3-methylpyrazin-2-yl)ethanimidamide (PubChem CID 83676288) has the molecular formula C7H10N4 and a molecular weight of 150.19 g/mol. Its IUPAC name is 2-(3-methylpyrazin-2-yl)ethanimidamide.

Molecular Properties

Compound Name2-(3-methylpyrazin-2-yl)ethanimidamide
PubChem CID83676288
Molecular FormulaC7H10N4
Molecular Weight150.19 g/mol
Exact Mass150.09
IUPAC Name2-(3-methylpyrazin-2-yl)ethanimidamide
SMILES[H]/N=C(\N)Cc1nccnc1C
InChIInChI=1S/C7H10N4/c1-5-6(4-7(8)9)11-3-2-10-5/h2-3H,4H2,1H3,(H3,8,9)
InChIKeyFKZKZNGAGUMWCD-UHFFFAOYSA-N
XLogP0.26
TPSA75.65 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.19
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylpyrazin-2-yl)ethanimidamide?
The IUPAC name of 2-(3-methylpyrazin-2-yl)ethanimidamide (CID 83676288) is 2-(3-methylpyrazin-2-yl)ethanimidamide.
What is the SMILES notation for 2-(3-methylpyrazin-2-yl)ethanimidamide?
The canonical SMILES for 2-(3-methylpyrazin-2-yl)ethanimidamide is [H]/N=C(\N)Cc1nccnc1C.
What is the InChIKey of 2-(3-methylpyrazin-2-yl)ethanimidamide?
The InChIKey is FKZKZNGAGUMWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4/c1-5-6(4-7(8)9)11-3-2-10-5/h2-3H,4H2,1H3,(H3,8,9).
What are the key properties of 2-(3-methylpyrazin-2-yl)ethanimidamide?
2-(3-methylpyrazin-2-yl)ethanimidamide has a molecular weight of 150.19 g/mol, XLogP of 0.26, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylpyrazin-2-yl)ethanimidamide is sourced from PubChem (CID 83676288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).