[(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine

C11H14BrFN2 — CID 105340099

IUPAC[(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine
SMILESNNC(c1cccc(F)c1Br)C1CCC1
InChIInChI=1S/C11H14BrFN2/c12-10-8(5-2-6-9(10)13)11(15-14)7-3-1-4-7/h2,5-7,11,15H,1,3-4,14H2
InChIKeyOVBHFUZMDPDMCU-UHFFFAOYSA-N
MW273.15 g/mol
LogP2.89
Rot. Bonds3

About [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine

[(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine (PubChem CID 105340099) has the molecular formula C11H14BrFN2 and a molecular weight of 273.15 g/mol. Its IUPAC name is [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine
PubChem CID105340099
Molecular FormulaC11H14BrFN2
Molecular Weight273.15 g/mol
Exact Mass272.03
IUPAC Name[(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine
SMILESNNC(c1cccc(F)c1Br)C1CCC1
InChIInChI=1S/C11H14BrFN2/c12-10-8(5-2-6-9(10)13)11(15-14)7-3-1-4-7/h2,5-7,11,15H,1,3-4,14H2
InChIKeyOVBHFUZMDPDMCU-UHFFFAOYSA-N
XLogP2.89
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.15
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine?
The IUPAC name of [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine (CID 105340099) is [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine.
What is the SMILES notation for [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine?
The canonical SMILES for [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine is NNC(c1cccc(F)c1Br)C1CCC1.
What is the InChIKey of [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine?
The InChIKey is OVBHFUZMDPDMCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrFN2/c12-10-8(5-2-6-9(10)13)11(15-14)7-3-1-4-7/h2,5-7,11,15H,1,3-4,14H2.
What are the key properties of [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine?
[(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine has a molecular weight of 273.15 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine is sourced from PubChem (CID 105340099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).