1-(3-bromo-2-fluorophenyl)butylhydrazine

C10H14BrFN2 — CID 106648656

IUPAC1-(3-bromo-2-fluorophenyl)butylhydrazine
SMILESCCCC(NN)c1cccc(Br)c1F
InChIInChI=1S/C10H14BrFN2/c1-2-4-9(14-13)7-5-3-6-8(11)10(7)12/h3,5-6,9,14H,2,4,13H2,1H3
InChIKeyBMJIMSMVXDUESK-UHFFFAOYSA-N
MW261.14 g/mol
LogP2.89
Rot. Bonds4

About 1-(3-bromo-2-fluorophenyl)butylhydrazine

1-(3-bromo-2-fluorophenyl)butylhydrazine (PubChem CID 106648656) has the molecular formula C10H14BrFN2 and a molecular weight of 261.14 g/mol. Its IUPAC name is 1-(3-bromo-2-fluorophenyl)butylhydrazine.

Molecular Properties

Compound Name1-(3-bromo-2-fluorophenyl)butylhydrazine
PubChem CID106648656
Molecular FormulaC10H14BrFN2
Molecular Weight261.14 g/mol
Exact Mass260.03
IUPAC Name1-(3-bromo-2-fluorophenyl)butylhydrazine
SMILESCCCC(NN)c1cccc(Br)c1F
InChIInChI=1S/C10H14BrFN2/c1-2-4-9(14-13)7-5-3-6-8(11)10(7)12/h3,5-6,9,14H,2,4,13H2,1H3
InChIKeyBMJIMSMVXDUESK-UHFFFAOYSA-N
XLogP2.89
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.14
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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Related Compounds

1-(3-bromo-2-fluorophenyl)octylhydrazine
CID 106649741
[1-(3-bromo-2-fluorophenyl)-4-ethylsulfonylbutyl]hydrazine
CID 107954240
[1-(3-bromo-2-fluorophenyl)-4-chlorobutyl]hydrazine
CID 106649111
1-(3-bromo-2-fluorophenyl)butan-1-amine
CID 103692974
[1-(3-bromo-2-fluorophenyl)-2-(5-ethylthiophen-2-yl)ethyl]hydrazine
CID 114020220
[1-(3-bromo-2-fluorophenyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 106649704
[1-(3-bromo-2-fluorophenyl)-3-(3-methylphenoxy)propyl]hydrazine
CID 106649751
1-(2,3-difluorophenyl)pentylhydrazine
CID 105245668
1-(3-bromo-2-fluorophenyl)-N-methylheptan-1-amine
CID 106648270
1-(3-bromo-2-fluorophenyl)-N-propylpentan-1-amine
CID 106645856
1-(3-bromo-2-fluorophenyl)-3-methyl-N-propylhexan-1-amine
CID 107952811
1-(2,3-difluorophenyl)hexylhydrazine
CID 105294688

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromo-2-fluorophenyl)butylhydrazine?
The IUPAC name of 1-(3-bromo-2-fluorophenyl)butylhydrazine (CID 106648656) is 1-(3-bromo-2-fluorophenyl)butylhydrazine.
What is the SMILES notation for 1-(3-bromo-2-fluorophenyl)butylhydrazine?
The canonical SMILES for 1-(3-bromo-2-fluorophenyl)butylhydrazine is CCCC(NN)c1cccc(Br)c1F.
What is the InChIKey of 1-(3-bromo-2-fluorophenyl)butylhydrazine?
The InChIKey is BMJIMSMVXDUESK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrFN2/c1-2-4-9(14-13)7-5-3-6-8(11)10(7)12/h3,5-6,9,14H,2,4,13H2,1H3.
What are the key properties of 1-(3-bromo-2-fluorophenyl)butylhydrazine?
1-(3-bromo-2-fluorophenyl)butylhydrazine has a molecular weight of 261.14 g/mol, XLogP of 2.89, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromo-2-fluorophenyl)butylhydrazine is sourced from PubChem (CID 106648656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).