2-methyl-6-piperazin-1-ylpyrazine;hydrochloride

C9H15ClN4 — CID 90674676

IUPAC2-methyl-6-piperazin-1-ylpyrazine;hydrochloride
SMILESCc1cncc(N2CCNCC2)n1.Cl
InChIInChI=1S/C9H14N4.ClH/c1-8-6-11-7-9(12-8)13-4-2-10-3-5-13;/h6-7,10H,2-5H2,1H3;1H
InChIKeyPAIIFQWLSMPRKS-UHFFFAOYSA-N
MW214.70 g/mol
LogP0.62
Rot. Bonds1

About 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride

2-methyl-6-piperazin-1-ylpyrazine;hydrochloride (PubChem CID 90674676) has the molecular formula C9H15ClN4 and a molecular weight of 214.70 g/mol. Its IUPAC name is 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride.

Molecular Properties

Compound Name2-methyl-6-piperazin-1-ylpyrazine;hydrochloride
PubChem CID90674676
Molecular FormulaC9H15ClN4
Molecular Weight214.70 g/mol
Exact Mass214.10
IUPAC Name2-methyl-6-piperazin-1-ylpyrazine;hydrochloride
SMILESCc1cncc(N2CCNCC2)n1.Cl
InChIInChI=1S/C9H14N4.ClH/c1-8-6-11-7-9(12-8)13-4-2-10-3-5-13;/h6-7,10H,2-5H2,1H3;1H
InChIKeyPAIIFQWLSMPRKS-UHFFFAOYSA-N
XLogP0.62
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.70
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride?
The IUPAC name of 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride (CID 90674676) is 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride.
What is the SMILES notation for 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride?
The canonical SMILES for 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride is Cc1cncc(N2CCNCC2)n1.Cl.
What is the InChIKey of 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride?
The InChIKey is PAIIFQWLSMPRKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4.ClH/c1-8-6-11-7-9(12-8)13-4-2-10-3-5-13;/h6-7,10H,2-5H2,1H3;1H.
What are the key properties of 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride?
2-methyl-6-piperazin-1-ylpyrazine;hydrochloride has a molecular weight of 214.70 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-piperazin-1-ylpyrazine;hydrochloride is sourced from PubChem (CID 90674676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).