[1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine

C11H16BrN3 — CID 105267791

IUPAC[1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine
SMILESNNC(CC1CCC1)c1ccc(Br)cn1
InChIInChI=1S/C11H16BrN3/c12-9-4-5-10(14-7-9)11(15-13)6-8-2-1-3-8/h4-5,7-8,11,15H,1-3,6,13H2
InChIKeyGNIPKOROIKKFKN-UHFFFAOYSA-N
MW270.17 g/mol
LogP2.54
Rot. Bonds4

About [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine

[1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine (PubChem CID 105267791) has the molecular formula C11H16BrN3 and a molecular weight of 270.17 g/mol. Its IUPAC name is [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine
PubChem CID105267791
Molecular FormulaC11H16BrN3
Molecular Weight270.17 g/mol
Exact Mass269.05
IUPAC Name[1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine
SMILESNNC(CC1CCC1)c1ccc(Br)cn1
InChIInChI=1S/C11H16BrN3/c12-9-4-5-10(14-7-9)11(15-13)6-8-2-1-3-8/h4-5,7-8,11,15H,1-3,6,13H2
InChIKeyGNIPKOROIKKFKN-UHFFFAOYSA-N
XLogP2.54
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine?
The IUPAC name of [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine (CID 105267791) is [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine.
What is the SMILES notation for [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine?
The canonical SMILES for [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine is NNC(CC1CCC1)c1ccc(Br)cn1.
What is the InChIKey of [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine?
The InChIKey is GNIPKOROIKKFKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3/c12-9-4-5-10(14-7-9)11(15-13)6-8-2-1-3-8/h4-5,7-8,11,15H,1-3,6,13H2.
What are the key properties of [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine?
[1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine has a molecular weight of 270.17 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-2-pyridinyl)-2-cyclobutylethyl]hydrazine is sourced from PubChem (CID 105267791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).