(6-fluoro-3-pyridinyl)hydrazine;dihydrochloride

C5H8Cl2FN3 — CID 139026675

IUPAC(6-fluoro-3-pyridinyl)hydrazine;dihydrochloride
SMILESCl.Cl.NNc1ccc(F)nc1
InChIInChI=1S/C5H6FN3.2ClH/c6-5-2-1-4(9-7)3-8-5;;/h1-3,9H,7H2;2*1H
InChIKeyXMSRUTVYXWVGFS-UHFFFAOYSA-N
MW200.04 g/mol
LogP1.35
Rot. Bonds1

About (6-fluoro-3-pyridinyl)hydrazine;dihydrochloride

(6-fluoro-3-pyridinyl)hydrazine;dihydrochloride (PubChem CID 139026675) has the molecular formula C5H8Cl2FN3 and a molecular weight of 200.04 g/mol. Its IUPAC name is (6-fluoro-3-pyridinyl)hydrazine;dihydrochloride.

Molecular Properties

Compound Name(6-fluoro-3-pyridinyl)hydrazine;dihydrochloride
PubChem CID139026675
Molecular FormulaC5H8Cl2FN3
Molecular Weight200.04 g/mol
Exact Mass199.01
IUPAC Name(6-fluoro-3-pyridinyl)hydrazine;dihydrochloride
SMILESCl.Cl.NNc1ccc(F)nc1
InChIInChI=1S/C5H6FN3.2ClH/c6-5-2-1-4(9-7)3-8-5;;/h1-3,9H,7H2;2*1H
InChIKeyXMSRUTVYXWVGFS-UHFFFAOYSA-N
XLogP1.35
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.04
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', '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-fluoro-3-pyridinyl)hydrazine;dihydrochloride?
The IUPAC name of (6-fluoro-3-pyridinyl)hydrazine;dihydrochloride (CID 139026675) is (6-fluoro-3-pyridinyl)hydrazine;dihydrochloride.
What is the SMILES notation for (6-fluoro-3-pyridinyl)hydrazine;dihydrochloride?
The canonical SMILES for (6-fluoro-3-pyridinyl)hydrazine;dihydrochloride is Cl.Cl.NNc1ccc(F)nc1.
What is the InChIKey of (6-fluoro-3-pyridinyl)hydrazine;dihydrochloride?
The InChIKey is XMSRUTVYXWVGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6FN3.2ClH/c6-5-2-1-4(9-7)3-8-5;;/h1-3,9H,7H2;2*1H.
What are the key properties of (6-fluoro-3-pyridinyl)hydrazine;dihydrochloride?
(6-fluoro-3-pyridinyl)hydrazine;dihydrochloride has a molecular weight of 200.04 g/mol, XLogP of 1.35, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-fluoro-3-pyridinyl)hydrazine;dihydrochloride is sourced from PubChem (CID 139026675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).