1-amino-2-(pyrazin-2-ylmethyl)guanidine

C6H10N6 — CID 21319533

IUPAC1-amino-2-(pyrazin-2-ylmethyl)guanidine
SMILESNN/C(N)=N/Cc1cnccn1
InChIInChI=1S/C6H10N6/c7-6(12-8)11-4-5-3-9-1-2-10-5/h1-3H,4,8H2,(H3,7,11,12)
InChIKeyMDNVVVUHUCMZCK-UHFFFAOYSA-N
MW166.19 g/mol
LogP-1.25
Rot. Bonds2

About 1-amino-2-(pyrazin-2-ylmethyl)guanidine

1-amino-2-(pyrazin-2-ylmethyl)guanidine (PubChem CID 21319533) has the molecular formula C6H10N6 and a molecular weight of 166.19 g/mol. Its IUPAC name is 1-amino-2-(pyrazin-2-ylmethyl)guanidine.

Molecular Properties

Compound Name1-amino-2-(pyrazin-2-ylmethyl)guanidine
PubChem CID21319533
Molecular FormulaC6H10N6
Molecular Weight166.19 g/mol
Exact Mass166.10
IUPAC Name1-amino-2-(pyrazin-2-ylmethyl)guanidine
SMILESNN/C(N)=N/Cc1cnccn1
InChIInChI=1S/C6H10N6/c7-6(12-8)11-4-5-3-9-1-2-10-5/h1-3H,4,8H2,(H3,7,11,12)
InChIKeyMDNVVVUHUCMZCK-UHFFFAOYSA-N
XLogP-1.25
TPSA102.21 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.19
LogP ≤ 5-1.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1H-1,2,4-Triazole-3-thiol, 5-(2-pyrazinyl)-
CID 830137
N'-aminopyrazine-2-carboximidamide
CID 2800188
Pyrazine-2-carboximidohydrazide
CID 9583164
N'-methylpyrazine-2-carboximidamide
CID 63182040
N'-(methylamino)pyrazine-2-carboxamidine
CID 68371185
N,N'-diaminopyrazine-2-carboximidamide
CID 90817388
Pyrazin-2-ylmethylazanium
CID 6994208
n'-Methylpyrazine-2-carbohydrazonamide
CID 11159409
1-N-(pyrazin-2-ylmethyl)-2H-pyridine-1,6-diamine
CID 19911496
2-(Hydrazinylmethyl)pyrazine
CID 20114790
2-(Hydrazinylmethyl)-5-methylpyrazine
CID 20118273
2-[2-(Pyrazin-2-ylmethylamino)ethyl]guanidine
CID 20567476

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-(pyrazin-2-ylmethyl)guanidine?
The IUPAC name of 1-amino-2-(pyrazin-2-ylmethyl)guanidine (CID 21319533) is 1-amino-2-(pyrazin-2-ylmethyl)guanidine.
What is the SMILES notation for 1-amino-2-(pyrazin-2-ylmethyl)guanidine?
The canonical SMILES for 1-amino-2-(pyrazin-2-ylmethyl)guanidine is NN/C(N)=N/Cc1cnccn1.
What is the InChIKey of 1-amino-2-(pyrazin-2-ylmethyl)guanidine?
The InChIKey is MDNVVVUHUCMZCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N6/c7-6(12-8)11-4-5-3-9-1-2-10-5/h1-3H,4,8H2,(H3,7,11,12).
What are the key properties of 1-amino-2-(pyrazin-2-ylmethyl)guanidine?
1-amino-2-(pyrazin-2-ylmethyl)guanidine has a molecular weight of 166.19 g/mol, XLogP of -1.25, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(pyrazin-2-ylmethyl)guanidine is sourced from PubChem (CID 21319533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).