[isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine

C15H15N5 — CID 105306415

IUPAC[isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine
SMILESCc1cnc(C(NN)c2cncc3ccccc23)cn1
InChIInChI=1S/C15H15N5/c1-10-6-19-14(9-18-10)15(20-16)13-8-17-7-11-4-2-3-5-12(11)13/h2-9,15,20H,16H2,1H3
InChIKeyHNGPULCYWINXOI-UHFFFAOYSA-N
MW265.32 g/mol
LogP1.89
Rot. Bonds3

About [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine

[isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine (PubChem CID 105306415) has the molecular formula C15H15N5 and a molecular weight of 265.32 g/mol. Its IUPAC name is [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine
PubChem CID105306415
Molecular FormulaC15H15N5
Molecular Weight265.32 g/mol
Exact Mass265.13
IUPAC Name[isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine
SMILESCc1cnc(C(NN)c2cncc3ccccc23)cn1
InChIInChI=1S/C15H15N5/c1-10-6-19-14(9-18-10)15(20-16)13-8-17-7-11-4-2-3-5-12(11)13/h2-9,15,20H,16H2,1H3
InChIKeyHNGPULCYWINXOI-UHFFFAOYSA-N
XLogP1.89
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 51.89
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 [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine?
The IUPAC name of [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine (CID 105306415) is [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine.
What is the SMILES notation for [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine?
The canonical SMILES for [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine is Cc1cnc(C(NN)c2cncc3ccccc23)cn1.
What is the InChIKey of [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine?
The InChIKey is HNGPULCYWINXOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5/c1-10-6-19-14(9-18-10)15(20-16)13-8-17-7-11-4-2-3-5-12(11)13/h2-9,15,20H,16H2,1H3.
What are the key properties of [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine?
[isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine has a molecular weight of 265.32 g/mol, XLogP of 1.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [isoquinolin-4-yl-(5-methylpyrazin-2-yl)methyl]hydrazine is sourced from PubChem (CID 105306415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).