hydron;2,3,5,6-tetramethylpyrazine;chloride

C8H13ClN2 — CID 45108167

IUPAChydron;2,3,5,6-tetramethylpyrazine;chloride
SMILESCc1nc(C)c(C)nc1C.[Cl-].[H+]
InChIInChI=1S/C8H12N2.ClH/c1-5-6(2)10-8(4)7(3)9-5;/h1-4H3;1H
InChIKeyRQKFOGXUTRDQPB-UHFFFAOYSA-N
MW172.66 g/mol
LogP-1.17
Rot. Bonds

About hydron;2,3,5,6-tetramethylpyrazine;chloride

hydron;2,3,5,6-tetramethylpyrazine;chloride (PubChem CID 45108167) has the molecular formula C8H13ClN2 and a molecular weight of 172.66 g/mol. Its IUPAC name is hydron;2,3,5,6-tetramethylpyrazine;chloride.

Molecular Properties

Compound Namehydron;2,3,5,6-tetramethylpyrazine;chloride
PubChem CID45108167
Molecular FormulaC8H13ClN2
Molecular Weight172.66 g/mol
Exact Mass172.08
IUPAC Namehydron;2,3,5,6-tetramethylpyrazine;chloride
SMILESCc1nc(C)c(C)nc1C.[Cl-].[H+]
InChIInChI=1S/C8H12N2.ClH/c1-5-6(2)10-8(4)7(3)9-5;/h1-4H3;1H
InChIKeyRQKFOGXUTRDQPB-UHFFFAOYSA-N
XLogP-1.17
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.66
LogP ≤ 5-1.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of hydron;2,3,5,6-tetramethylpyrazine;chloride?
The IUPAC name of hydron;2,3,5,6-tetramethylpyrazine;chloride (CID 45108167) is hydron;2,3,5,6-tetramethylpyrazine;chloride.
What is the SMILES notation for hydron;2,3,5,6-tetramethylpyrazine;chloride?
The canonical SMILES for hydron;2,3,5,6-tetramethylpyrazine;chloride is Cc1nc(C)c(C)nc1C.[Cl-].[H+].
What is the InChIKey of hydron;2,3,5,6-tetramethylpyrazine;chloride?
The InChIKey is RQKFOGXUTRDQPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2.ClH/c1-5-6(2)10-8(4)7(3)9-5;/h1-4H3;1H.
What are the key properties of hydron;2,3,5,6-tetramethylpyrazine;chloride?
hydron;2,3,5,6-tetramethylpyrazine;chloride has a molecular weight of 172.66 g/mol, XLogP of -1.17, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;2,3,5,6-tetramethylpyrazine;chloride is sourced from PubChem (CID 45108167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).