[6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine

C7H12N4OS — CID 80922307

IUPAC[6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine
SMILESCOCCSc1cncc(NN)n1
InChIInChI=1S/C7H12N4OS/c1-12-2-3-13-7-5-9-4-6(10-7)11-8/h4-5H,2-3,8H2,1H3,(H,10,11)
InChIKeyVQORJIWMZGXCMI-UHFFFAOYSA-N
MW200.27 g/mol
LogP0.50
Rot. Bonds5

About [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine

[6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine (PubChem CID 80922307) has the molecular formula C7H12N4OS and a molecular weight of 200.27 g/mol. Its IUPAC name is [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine
PubChem CID80922307
Molecular FormulaC7H12N4OS
Molecular Weight200.27 g/mol
Exact Mass200.07
IUPAC Name[6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine
SMILESCOCCSc1cncc(NN)n1
InChIInChI=1S/C7H12N4OS/c1-12-2-3-13-7-5-9-4-6(10-7)11-8/h4-5H,2-3,8H2,1H3,(H,10,11)
InChIKeyVQORJIWMZGXCMI-UHFFFAOYSA-N
XLogP0.50
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.27
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine?
The IUPAC name of [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine (CID 80922307) is [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine.
What is the SMILES notation for [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine?
The canonical SMILES for [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine is COCCSc1cncc(NN)n1.
What is the InChIKey of [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine?
The InChIKey is VQORJIWMZGXCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4OS/c1-12-2-3-13-7-5-9-4-6(10-7)11-8/h4-5H,2-3,8H2,1H3,(H,10,11).
What are the key properties of [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine?
[6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine has a molecular weight of 200.27 g/mol, XLogP of 0.50, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methoxyethylsulfanyl)pyrazin-2-yl]hydrazine is sourced from PubChem (CID 80922307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).