[6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine

C12H19N5 — CID 82755530

IUPAC[6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine
SMILESNNc1cncc(N2CCC3CCCCC32)n1
InChIInChI=1S/C12H19N5/c13-16-11-7-14-8-12(15-11)17-6-5-9-3-1-2-4-10(9)17/h7-10H,1-6,13H2,(H,15,16)
InChIKeyXZGCJGPCDVTNII-UHFFFAOYSA-N
MW233.32 g/mol
LogP1.53
Rot. Bonds2

About [6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine

[6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine (PubChem CID 82755530) has the molecular formula C12H19N5 and a molecular weight of 233.32 g/mol. Its IUPAC name is [6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine.

Molecular Properties

Compound Name[6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine
PubChem CID82755530
Molecular FormulaC12H19N5
Molecular Weight233.32 g/mol
Exact Mass233.16
IUPAC Name[6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine
SMILESNNc1cncc(N2CCC3CCCCC32)n1
InChIInChI=1S/C12H19N5/c13-16-11-7-14-8-12(15-11)17-6-5-9-3-1-2-4-10(9)17/h7-10H,1-6,13H2,(H,15,16)
InChIKeyXZGCJGPCDVTNII-UHFFFAOYSA-N
XLogP1.53
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.32
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'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-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine?
The IUPAC name of [6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine (CID 82755530) is [6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine.
What is the SMILES notation for [6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine?
The canonical SMILES for [6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine is NNc1cncc(N2CCC3CCCCC32)n1.
What is the InChIKey of [6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine?
The InChIKey is XZGCJGPCDVTNII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5/c13-16-11-7-14-8-12(15-11)17-6-5-9-3-1-2-4-10(9)17/h7-10H,1-6,13H2,(H,15,16).
What are the key properties of [6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine?
[6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine has a molecular weight of 233.32 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)pyrazin-2-yl]hydrazine is sourced from PubChem (CID 82755530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).