(4-cyclobutyloxypyrimidin-2-yl)hydrazine

C8H12N4O — CID 80930849

IUPAC(4-cyclobutyloxypyrimidin-2-yl)hydrazine
SMILESNNc1nccc(OC2CCC2)n1
InChIInChI=1S/C8H12N4O/c9-12-8-10-5-4-7(11-8)13-6-2-1-3-6/h4-6H,1-3,9H2,(H,10,11,12)
InChIKeyMJUMRELMUFDTKI-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.69
Rot. Bonds3

About (4-cyclobutyloxypyrimidin-2-yl)hydrazine

(4-cyclobutyloxypyrimidin-2-yl)hydrazine (PubChem CID 80930849) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is (4-cyclobutyloxypyrimidin-2-yl)hydrazine.

Molecular Properties

Compound Name(4-cyclobutyloxypyrimidin-2-yl)hydrazine
PubChem CID80930849
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name(4-cyclobutyloxypyrimidin-2-yl)hydrazine
SMILESNNc1nccc(OC2CCC2)n1
InChIInChI=1S/C8H12N4O/c9-12-8-10-5-4-7(11-8)13-6-2-1-3-6/h4-6H,1-3,9H2,(H,10,11,12)
InChIKeyMJUMRELMUFDTKI-UHFFFAOYSA-N
XLogP0.69
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.69
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 (4-cyclobutyloxypyrimidin-2-yl)hydrazine?
The IUPAC name of (4-cyclobutyloxypyrimidin-2-yl)hydrazine (CID 80930849) is (4-cyclobutyloxypyrimidin-2-yl)hydrazine.
What is the SMILES notation for (4-cyclobutyloxypyrimidin-2-yl)hydrazine?
The canonical SMILES for (4-cyclobutyloxypyrimidin-2-yl)hydrazine is NNc1nccc(OC2CCC2)n1.
What is the InChIKey of (4-cyclobutyloxypyrimidin-2-yl)hydrazine?
The InChIKey is MJUMRELMUFDTKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c9-12-8-10-5-4-7(11-8)13-6-2-1-3-6/h4-6H,1-3,9H2,(H,10,11,12).
What are the key properties of (4-cyclobutyloxypyrimidin-2-yl)hydrazine?
(4-cyclobutyloxypyrimidin-2-yl)hydrazine has a molecular weight of 180.21 g/mol, XLogP of 0.69, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclobutyloxypyrimidin-2-yl)hydrazine is sourced from PubChem (CID 80930849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).