1-methyl-2H-pyrazine;hydrochloride

C5H9ClN2 — CID 70209125

IUPAC1-methyl-2H-pyrazine;hydrochloride
SMILESCN1C=CN=CC1.Cl
InChIInChI=1S/C5H8N2.ClH/c1-7-4-2-6-3-5-7;/h2-4H,5H2,1H3;1H
InChIKeyNOQSDSOVLIHSGE-UHFFFAOYSA-N
MW132.59 g/mol
LogP0.90
Rot. Bonds

About 1-methyl-2H-pyrazine;hydrochloride

1-methyl-2H-pyrazine;hydrochloride (PubChem CID 70209125) has the molecular formula C5H9ClN2 and a molecular weight of 132.59 g/mol. Its IUPAC name is 1-methyl-2H-pyrazine;hydrochloride.

Molecular Properties

Compound Name1-methyl-2H-pyrazine;hydrochloride
PubChem CID70209125
Molecular FormulaC5H9ClN2
Molecular Weight132.59 g/mol
Exact Mass132.05
IUPAC Name1-methyl-2H-pyrazine;hydrochloride
SMILESCN1C=CN=CC1.Cl
InChIInChI=1S/C5H8N2.ClH/c1-7-4-2-6-3-5-7;/h2-4H,5H2,1H3;1H
InChIKeyNOQSDSOVLIHSGE-UHFFFAOYSA-N
XLogP0.90
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.59
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2H-pyrazine;hydrochloride?
The IUPAC name of 1-methyl-2H-pyrazine;hydrochloride (CID 70209125) is 1-methyl-2H-pyrazine;hydrochloride.
What is the SMILES notation for 1-methyl-2H-pyrazine;hydrochloride?
The canonical SMILES for 1-methyl-2H-pyrazine;hydrochloride is CN1C=CN=CC1.Cl.
What is the InChIKey of 1-methyl-2H-pyrazine;hydrochloride?
The InChIKey is NOQSDSOVLIHSGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2.ClH/c1-7-4-2-6-3-5-7;/h2-4H,5H2,1H3;1H.
What are the key properties of 1-methyl-2H-pyrazine;hydrochloride?
1-methyl-2H-pyrazine;hydrochloride has a molecular weight of 132.59 g/mol, XLogP of 0.90, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2H-pyrazine;hydrochloride is sourced from PubChem (CID 70209125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).