[1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine

C12H16BrFN2 — CID 105315093

IUPAC[1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine
SMILESNNC(CCC1CC1)c1ccc(F)cc1Br
InChIInChI=1S/C12H16BrFN2/c13-11-7-9(14)4-5-10(11)12(16-15)6-3-8-1-2-8/h4-5,7-8,12,16H,1-3,6,15H2
InChIKeyOHHNMATWCSUEFO-UHFFFAOYSA-N
MW287.18 g/mol
LogP3.28
Rot. Bonds5

About [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine

[1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine (PubChem CID 105315093) has the molecular formula C12H16BrFN2 and a molecular weight of 287.18 g/mol. Its IUPAC name is [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine
PubChem CID105315093
Molecular FormulaC12H16BrFN2
Molecular Weight287.18 g/mol
Exact Mass286.05
IUPAC Name[1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine
SMILESNNC(CCC1CC1)c1ccc(F)cc1Br
InChIInChI=1S/C12H16BrFN2/c13-11-7-9(14)4-5-10(11)12(16-15)6-3-8-1-2-8/h4-5,7-8,12,16H,1-3,6,15H2
InChIKeyOHHNMATWCSUEFO-UHFFFAOYSA-N
XLogP3.28
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
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

[1-(2-bromo-4-fluorophenyl)-2-cyclobutylethyl]hydrazine
CID 105310051
[1-(2-chloro-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine
CID 105215437
[1-(2-bromo-4-fluorophenyl)-2-cyclohexylethyl]hydrazine
CID 105296167
[3-cyclohexyl-1-(2,4-dibromophenyl)propyl]hydrazine
CID 114193446
[1-(5-chloro-2-fluorophenyl)-3-cyclopropylpropyl]hydrazine
CID 105280162
[1-(2-bromo-4-fluorophenyl)-2-ethoxyethyl]hydrazine
CID 105321215
[1-(3-bromo-2-chlorophenyl)-3-cyclopropylpropyl]hydrazine
CID 105315169
[1-(2-bromo-5-methoxyphenyl)-3-cyclopropylpropyl]hydrazine
CID 105315167
1-(2-bromo-4-fluorophenyl)-2-cyclopentyl-N-ethylethanamine
CID 115847237
[1-(4-bromo-3-chlorophenyl)-3-cyclopropylpropyl]hydrazine
CID 105315140
N-[1-(2-bromo-4-fluorophenyl)-2-cyclobutylethyl]propan-1-amine
CID 115863366
[3-cyclopropyl-1-(3,5-dibromo-2-pyridinyl)propyl]hydrazine
CID 105268447

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine?
The IUPAC name of [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine (CID 105315093) is [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine.
What is the SMILES notation for [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine?
The canonical SMILES for [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine is NNC(CCC1CC1)c1ccc(F)cc1Br.
What is the InChIKey of [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine?
The InChIKey is OHHNMATWCSUEFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16BrFN2/c13-11-7-9(14)4-5-10(11)12(16-15)6-3-8-1-2-8/h4-5,7-8,12,16H,1-3,6,15H2.
What are the key properties of [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine?
[1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine has a molecular weight of 287.18 g/mol, XLogP of 3.28, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-4-fluorophenyl)-3-cyclopropylpropyl]hydrazine is sourced from PubChem (CID 105315093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).