1-methyl-2H-pyrazine;hydroiodide

C5H9IN2 — CID 70123461

IUPAC1-methyl-2H-pyrazine;hydroiodide
SMILESCN1C=CN=CC1.I
InChIInChI=1S/C5H8N2.HI/c1-7-4-2-6-3-5-7;/h2-4H,5H2,1H3;1H
InChIKeyPLARCLGYNHTNFW-UHFFFAOYSA-N
MW224.04 g/mol
LogP1.09
Rot. Bonds

About 1-methyl-2H-pyrazine;hydroiodide

1-methyl-2H-pyrazine;hydroiodide (PubChem CID 70123461) has the molecular formula C5H9IN2 and a molecular weight of 224.04 g/mol. Its IUPAC name is 1-methyl-2H-pyrazine;hydroiodide.

Molecular Properties

Compound Name1-methyl-2H-pyrazine;hydroiodide
PubChem CID70123461
Molecular FormulaC5H9IN2
Molecular Weight224.04 g/mol
Exact Mass223.98
IUPAC Name1-methyl-2H-pyrazine;hydroiodide
SMILESCN1C=CN=CC1.I
InChIInChI=1S/C5H8N2.HI/c1-7-4-2-6-3-5-7;/h2-4H,5H2,1H3;1H
InChIKeyPLARCLGYNHTNFW-UHFFFAOYSA-N
XLogP1.09
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.04
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

1-(Prop-1-en-1-yl)-1,2-dihydropyrazine
CID 71361020
Dihydromethylpyrazine
CID 21134130
6-iodo-1-methyl-2H-pyrazine
CID 53870936
N-ethylpyrazine
CID 90427580
Pyrazinium, 1,4-dimethyl-
CID 17841205
1-propan-2-yl-2H-pyrazine
CID 20641789
1,2-dimethyl-2H-pyrazine
CID 20728182
4-ethyl-1-methyl-2H-pyrazin-4-ium
CID 23148541
1,4-diethyl-2H-pyrazin-4-ium
CID 23148550
4-methyl-1-propyl-2H-pyrazin-4-ium
CID 23148573
Pyrazinamine, 4,5-dihydro-4-methyl-
CID 45116673
1-propyl-2H-pyrazine
CID 53446009

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2H-pyrazine;hydroiodide?
The IUPAC name of 1-methyl-2H-pyrazine;hydroiodide (CID 70123461) is 1-methyl-2H-pyrazine;hydroiodide.
What is the SMILES notation for 1-methyl-2H-pyrazine;hydroiodide?
The canonical SMILES for 1-methyl-2H-pyrazine;hydroiodide is CN1C=CN=CC1.I.
What is the InChIKey of 1-methyl-2H-pyrazine;hydroiodide?
The InChIKey is PLARCLGYNHTNFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2.HI/c1-7-4-2-6-3-5-7;/h2-4H,5H2,1H3;1H.
What are the key properties of 1-methyl-2H-pyrazine;hydroiodide?
1-methyl-2H-pyrazine;hydroiodide has a molecular weight of 224.04 g/mol, XLogP of 1.09, 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;hydroiodide is sourced from PubChem (CID 70123461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).