N'-methylpyrazine-2-carboximidamide

C6H8N4 — CID 63182040

IUPACN'-methylpyrazine-2-carboximidamide
SMILESC/N=C(\N)c1cnccn1
InChIInChI=1S/C6H8N4/c1-8-6(7)5-4-9-2-3-10-5/h2-4H,1H3,(H2,7,8)
InChIKeyUMKXZLXMHLWARO-UHFFFAOYSA-N
MW136.16 g/mol
LogP-0.19
Rot. Bonds1

About N'-methylpyrazine-2-carboximidamide

N'-methylpyrazine-2-carboximidamide (PubChem CID 63182040) has the molecular formula C6H8N4 and a molecular weight of 136.16 g/mol. Its IUPAC name is N'-methylpyrazine-2-carboximidamide.

Molecular Properties

Compound NameN'-methylpyrazine-2-carboximidamide
PubChem CID63182040
Molecular FormulaC6H8N4
Molecular Weight136.16 g/mol
Exact Mass136.07
IUPAC NameN'-methylpyrazine-2-carboximidamide
SMILESC/N=C(\N)c1cnccn1
InChIInChI=1S/C6H8N4/c1-8-6(7)5-4-9-2-3-10-5/h2-4H,1H3,(H2,7,8)
InChIKeyUMKXZLXMHLWARO-UHFFFAOYSA-N
XLogP-0.19
TPSA64.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.16
LogP ≤ 5-0.19
H-Bond Donors ≤ 51
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 N'-methylpyrazine-2-carboximidamide?
The IUPAC name of N'-methylpyrazine-2-carboximidamide (CID 63182040) is N'-methylpyrazine-2-carboximidamide.
What is the SMILES notation for N'-methylpyrazine-2-carboximidamide?
The canonical SMILES for N'-methylpyrazine-2-carboximidamide is C/N=C(\N)c1cnccn1.
What is the InChIKey of N'-methylpyrazine-2-carboximidamide?
The InChIKey is UMKXZLXMHLWARO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4/c1-8-6(7)5-4-9-2-3-10-5/h2-4H,1H3,(H2,7,8).
What are the key properties of N'-methylpyrazine-2-carboximidamide?
N'-methylpyrazine-2-carboximidamide has a molecular weight of 136.16 g/mol, XLogP of -0.19, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methylpyrazine-2-carboximidamide is sourced from PubChem (CID 63182040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).