2H-pyrazine-1-carboximidamide;hydrochloride

C5H9ClN4 — CID 22608694

IUPAC2H-pyrazine-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)N1C=CN=CC1
InChIInChI=1S/C5H8N4.ClH/c6-5(7)9-3-1-8-2-4-9;/h1-3H,4H2,(H3,6,7);1H
InChIKeyNPWATCJDFOSIAH-UHFFFAOYSA-N
MW160.61 g/mol
LogP0.16
Rot. Bonds

About 2H-pyrazine-1-carboximidamide;hydrochloride

2H-pyrazine-1-carboximidamide;hydrochloride (PubChem CID 22608694) has the molecular formula C5H9ClN4 and a molecular weight of 160.61 g/mol. Its IUPAC name is 2H-pyrazine-1-carboximidamide;hydrochloride.

Molecular Properties

Compound Name2H-pyrazine-1-carboximidamide;hydrochloride
PubChem CID22608694
Molecular FormulaC5H9ClN4
Molecular Weight160.61 g/mol
Exact Mass160.05
IUPAC Name2H-pyrazine-1-carboximidamide;hydrochloride
SMILESCl.[H]/N=C(\N)N1C=CN=CC1
InChIInChI=1S/C5H8N4.ClH/c6-5(7)9-3-1-8-2-4-9;/h1-3H,4H2,(H3,6,7);1H
InChIKeyNPWATCJDFOSIAH-UHFFFAOYSA-N
XLogP0.16
TPSA65.47 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.61
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 2H-pyrazine-1-carboximidamide;hydrochloride?
The IUPAC name of 2H-pyrazine-1-carboximidamide;hydrochloride (CID 22608694) is 2H-pyrazine-1-carboximidamide;hydrochloride.
What is the SMILES notation for 2H-pyrazine-1-carboximidamide;hydrochloride?
The canonical SMILES for 2H-pyrazine-1-carboximidamide;hydrochloride is Cl.[H]/N=C(\N)N1C=CN=CC1.
What is the InChIKey of 2H-pyrazine-1-carboximidamide;hydrochloride?
The InChIKey is NPWATCJDFOSIAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4.ClH/c6-5(7)9-3-1-8-2-4-9;/h1-3H,4H2,(H3,6,7);1H.
What are the key properties of 2H-pyrazine-1-carboximidamide;hydrochloride?
2H-pyrazine-1-carboximidamide;hydrochloride has a molecular weight of 160.61 g/mol, XLogP of 0.16, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyrazine-1-carboximidamide;hydrochloride is sourced from PubChem (CID 22608694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).