2,5-dimethylpyrazine;hydrochloride

C6H9ClN2 — CID 160725136

IUPAC2,5-dimethylpyrazine;hydrochloride
SMILESCc1cnc(C)cn1.Cl
InChIInChI=1S/C6H8N2.ClH/c1-5-3-8-6(2)4-7-5;/h3-4H,1-2H3;1H
InChIKeyRTPLCYNAEQZNQR-UHFFFAOYSA-N
MW144.60 g/mol
LogP1.52
Rot. Bonds

About 2,5-dimethylpyrazine;hydrochloride

2,5-dimethylpyrazine;hydrochloride (PubChem CID 160725136) has the molecular formula C6H9ClN2 and a molecular weight of 144.60 g/mol. Its IUPAC name is 2,5-dimethylpyrazine;hydrochloride.

Molecular Properties

Compound Name2,5-dimethylpyrazine;hydrochloride
PubChem CID160725136
Molecular FormulaC6H9ClN2
Molecular Weight144.60 g/mol
Exact Mass144.05
IUPAC Name2,5-dimethylpyrazine;hydrochloride
SMILESCc1cnc(C)cn1.Cl
InChIInChI=1S/C6H8N2.ClH/c1-5-3-8-6(2)4-7-5;/h3-4H,1-2H3;1H
InChIKeyRTPLCYNAEQZNQR-UHFFFAOYSA-N
XLogP1.52
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.60
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 143125119
2,5-dimethylpyrazine;2,3,5-trimethylpyrazine
CID 69044023
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CID 2756496
N,5-dimethylpyrazin-2-amine
CID 59693926
2-(2-chloroethyl)-5-methylpyrazine;hydrochloride
CID 75480801
ethane;(5-methylpyrazin-2-yl)methanamine
CID 143579527
2-(iodomethyl)-5-methylpyrazine
CID 118184663
(5-methylpyrazin-2-yl)methanethiol
CID 90983468
2-cyclopropyl-5-methylpyrazine;ethane
CID 144646569
2-methyl-5-[(2-methylpropan-2-yl)oxy]pyrazine
CID 59273469
2-methyl-5-prop-1-en-2-ylpyrazine
CID 22151788
2-methyl-5-(triazol-2-yl)pyrazine
CID 70234442

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpyrazine;hydrochloride?
The IUPAC name of 2,5-dimethylpyrazine;hydrochloride (CID 160725136) is 2,5-dimethylpyrazine;hydrochloride.
What is the SMILES notation for 2,5-dimethylpyrazine;hydrochloride?
The canonical SMILES for 2,5-dimethylpyrazine;hydrochloride is Cc1cnc(C)cn1.Cl.
What is the InChIKey of 2,5-dimethylpyrazine;hydrochloride?
The InChIKey is RTPLCYNAEQZNQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2.ClH/c1-5-3-8-6(2)4-7-5;/h3-4H,1-2H3;1H.
What are the key properties of 2,5-dimethylpyrazine;hydrochloride?
2,5-dimethylpyrazine;hydrochloride has a molecular weight of 144.60 g/mol, XLogP of 1.52, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylpyrazine;hydrochloride is sourced from PubChem (CID 160725136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).