[(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine

C12H16BrFN2 — CID 105238562

IUPAC[(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine
SMILESNNC(c1cc(F)cc(Br)c1)C1CCCC1
InChIInChI=1S/C12H16BrFN2/c13-10-5-9(6-11(14)7-10)12(16-15)8-3-1-2-4-8/h5-8,12,16H,1-4,15H2
InChIKeyYXXURKOJMDFLQY-UHFFFAOYSA-N
MW287.18 g/mol
LogP3.28
Rot. Bonds3

About [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine

[(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine (PubChem CID 105238562) has the molecular formula C12H16BrFN2 and a molecular weight of 287.18 g/mol. Its IUPAC name is [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine.

Molecular Properties

Compound Name[(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine
PubChem CID105238562
Molecular FormulaC12H16BrFN2
Molecular Weight287.18 g/mol
Exact Mass286.05
IUPAC Name[(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine
SMILESNNC(c1cc(F)cc(Br)c1)C1CCCC1
InChIInChI=1S/C12H16BrFN2/c13-10-5-9(6-11(14)7-10)12(16-15)8-3-1-2-4-8/h5-8,12,16H,1-4,15H2
InChIKeyYXXURKOJMDFLQY-UHFFFAOYSA-N
XLogP3.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.18
LogP ≤ 53.28
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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Related Compounds

[(3-bromo-5-fluorophenyl)-cyclobutylmethyl]hydrazine
CID 105238751
1-(3-bromo-5-fluorophenyl)-1-cyclohexyl-N-methylmethanamine
CID 66424249
[cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine
CID 105232121
(1R,2S)-2-amino-2-(3-bromo-5-fluorophenyl)-1-cyclopentylethanol
CID 171267775
(3-bromo-5-fluorophenyl)-cyclohexylmethanol
CID 66425421
[(4-bromo-3-fluorophenyl)-cyclobutylmethyl]hydrazine
CID 105340166
(1R,2S)-2-amino-2-(3-bromo-5-fluorophenyl)-1-cyclohexylethanol
CID 171267777
[(3-bromo-4-fluorophenyl)-cyclopentylmethyl]hydrazine
CID 105264024
[(3,5-difluorophenyl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine
CID 105301886
[(5-bromothiophen-3-yl)-cycloheptylmethyl]hydrazine
CID 105330730
N-[(3-bromo-5-fluorophenyl)-(4-methylcyclohexyl)methyl]ethanamine
CID 66425051
[(3,5-difluorophenyl)-(2-ethylcyclohexyl)methyl]hydrazine
CID 105207871

Frequently Asked Questions

What is the IUPAC name of [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine?
The IUPAC name of [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine (CID 105238562) is [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine.
What is the SMILES notation for [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine?
The canonical SMILES for [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine is NNC(c1cc(F)cc(Br)c1)C1CCCC1.
What is the InChIKey of [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine?
The InChIKey is YXXURKOJMDFLQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrFN2/c13-10-5-9(6-11(14)7-10)12(16-15)8-3-1-2-4-8/h5-8,12,16H,1-4,15H2.
What are the key properties of [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine?
[(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine has a molecular weight of 287.18 g/mol, XLogP of 3.28, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-bromo-5-fluorophenyl)-cyclopentylmethyl]hydrazine is sourced from PubChem (CID 105238562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).