(5-bromopyrimidin-4-yl)hydrazine

C4H5BrN4 — CID 55280232

IUPAC(5-bromopyrimidin-4-yl)hydrazine
SMILESNNc1ncncc1Br
InChIInChI=1S/C4H5BrN4/c5-3-1-7-2-8-4(3)9-6/h1-2H,6H2,(H,7,8,9)
InChIKeyCGJWBORAUALYIH-UHFFFAOYSA-N
MW189.02 g/mol
LogP0.52
Rot. Bonds1

About (5-bromopyrimidin-4-yl)hydrazine

(5-bromopyrimidin-4-yl)hydrazine (PubChem CID 55280232) has the molecular formula C4H5BrN4 and a molecular weight of 189.02 g/mol. Its IUPAC name is (5-bromopyrimidin-4-yl)hydrazine.

Molecular Properties

Compound Name(5-bromopyrimidin-4-yl)hydrazine
PubChem CID55280232
Molecular FormulaC4H5BrN4
Molecular Weight189.02 g/mol
Exact Mass187.97
IUPAC Name(5-bromopyrimidin-4-yl)hydrazine
SMILESNNc1ncncc1Br
InChIInChI=1S/C4H5BrN4/c5-3-1-7-2-8-4(3)9-6/h1-2H,6H2,(H,7,8,9)
InChIKeyCGJWBORAUALYIH-UHFFFAOYSA-N
XLogP0.52
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.02
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 (5-bromopyrimidin-4-yl)hydrazine?
The IUPAC name of (5-bromopyrimidin-4-yl)hydrazine (CID 55280232) is (5-bromopyrimidin-4-yl)hydrazine.
What is the SMILES notation for (5-bromopyrimidin-4-yl)hydrazine?
The canonical SMILES for (5-bromopyrimidin-4-yl)hydrazine is NNc1ncncc1Br.
What is the InChIKey of (5-bromopyrimidin-4-yl)hydrazine?
The InChIKey is CGJWBORAUALYIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5BrN4/c5-3-1-7-2-8-4(3)9-6/h1-2H,6H2,(H,7,8,9).
What are the key properties of (5-bromopyrimidin-4-yl)hydrazine?
(5-bromopyrimidin-4-yl)hydrazine has a molecular weight of 189.02 g/mol, XLogP of 0.52, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromopyrimidin-4-yl)hydrazine is sourced from PubChem (CID 55280232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).