(5-isocyano-2-pyridinyl)hydrazine

C6H6N4 — CID 59280195

IUPAC(5-isocyano-2-pyridinyl)hydrazine
SMILES[C-]#[N+]c1ccc(NN)nc1
InChIInChI=1S/C6H6N4/c1-8-5-2-3-6(10-7)9-4-5/h2-4H,7H2,(H,9,10)
InChIKeyFJINSNVQFINPAF-UHFFFAOYSA-N
MW134.14 g/mol
LogP0.92
Rot. Bonds1

About (5-isocyano-2-pyridinyl)hydrazine

(5-isocyano-2-pyridinyl)hydrazine (PubChem CID 59280195) has the molecular formula C6H6N4 and a molecular weight of 134.14 g/mol. Its IUPAC name is (5-isocyano-2-pyridinyl)hydrazine.

Molecular Properties

Compound Name(5-isocyano-2-pyridinyl)hydrazine
PubChem CID59280195
Molecular FormulaC6H6N4
Molecular Weight134.14 g/mol
Exact Mass134.06
IUPAC Name(5-isocyano-2-pyridinyl)hydrazine
SMILES[C-]#[N+]c1ccc(NN)nc1
InChIInChI=1S/C6H6N4/c1-8-5-2-3-6(10-7)9-4-5/h2-4H,7H2,(H,9,10)
InChIKeyFJINSNVQFINPAF-UHFFFAOYSA-N
XLogP0.92
TPSA55.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', '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 (5-isocyano-2-pyridinyl)hydrazine?
The IUPAC name of (5-isocyano-2-pyridinyl)hydrazine (CID 59280195) is (5-isocyano-2-pyridinyl)hydrazine.
What is the SMILES notation for (5-isocyano-2-pyridinyl)hydrazine?
The canonical SMILES for (5-isocyano-2-pyridinyl)hydrazine is [C-]#[N+]c1ccc(NN)nc1.
What is the InChIKey of (5-isocyano-2-pyridinyl)hydrazine?
The InChIKey is FJINSNVQFINPAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4/c1-8-5-2-3-6(10-7)9-4-5/h2-4H,7H2,(H,9,10).
What are the key properties of (5-isocyano-2-pyridinyl)hydrazine?
(5-isocyano-2-pyridinyl)hydrazine has a molecular weight of 134.14 g/mol, XLogP of 0.92, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-isocyano-2-pyridinyl)hydrazine is sourced from PubChem (CID 59280195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).