[1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine

C15H15BrClFN2O — CID 106649782

IUPAC[1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine
SMILESCC(Oc1cccc(Cl)c1)C(NN)c1cccc(Br)c1F
InChIInChI=1S/C15H15BrClFN2O/c1-9(21-11-5-2-4-10(17)8-11)15(20-19)12-6-3-7-13(16)14(12)18/h2-9,15,20H,19H2,1H3
InChIKeySTWLVFNRIJUNMU-UHFFFAOYSA-N
MW373.65 g/mol
LogP4.21
Rot. Bonds5

About [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine

[1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine (PubChem CID 106649782) has the molecular formula C15H15BrClFN2O and a molecular weight of 373.65 g/mol. Its IUPAC name is [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine
PubChem CID106649782
Molecular FormulaC15H15BrClFN2O
Molecular Weight373.65 g/mol
Exact Mass372.00
IUPAC Name[1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine
SMILESCC(Oc1cccc(Cl)c1)C(NN)c1cccc(Br)c1F
InChIInChI=1S/C15H15BrClFN2O/c1-9(21-11-5-2-4-10(17)8-11)15(20-19)12-6-3-7-13(16)14(12)18/h2-9,15,20H,19H2,1H3
InChIKeySTWLVFNRIJUNMU-UHFFFAOYSA-N
XLogP4.21
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.65
LogP ≤ 54.21
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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Related Compounds

[2-(3-chlorophenoxy)-1-(2,3-difluorophenyl)propyl]hydrazine
CID 105309301
[2-(3-chlorophenoxy)-1-(2-methoxyphenyl)propyl]hydrazine
CID 105285682
[2-(3-chlorophenoxy)-1-(2,4-difluorophenyl)propyl]hydrazine
CID 105303167
[1-(5-bromo-3-methyltriazol-4-yl)-2-(3-chlorophenoxy)propyl]hydrazine
CID 106466368
[1-(3-chloro-4-methylphenyl)-2-(3-chlorophenoxy)propyl]hydrazine
CID 107562651
[2-(3-chlorophenoxy)-1-thiophen-3-ylpropyl]hydrazine
CID 105311964
[2-(3-chlorophenoxy)-1-(1-methylpyrazol-4-yl)propyl]hydrazine
CID 105288679
2-(3-chlorophenoxy)-1-(2-fluorophenyl)propan-1-ol
CID 105083853
2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine
CID 105099609
1-(2-chloro-5-fluorophenyl)-2-(3-chlorophenoxy)-N-methylpropan-1-amine
CID 105397219
[2-(3-chlorophenoxy)-1-(2-propylpyrazol-3-yl)propyl]hydrazine
CID 105306951
1-(3-bromothiophen-2-yl)-2-(3-chlorophenoxy)propan-1-ol
CID 105119310

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine?
The IUPAC name of [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine (CID 106649782) is [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine.
What is the SMILES notation for [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine?
The canonical SMILES for [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine is CC(Oc1cccc(Cl)c1)C(NN)c1cccc(Br)c1F.
What is the InChIKey of [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine?
The InChIKey is STWLVFNRIJUNMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClFN2O/c1-9(21-11-5-2-4-10(17)8-11)15(20-19)12-6-3-7-13(16)14(12)18/h2-9,15,20H,19H2,1H3.
What are the key properties of [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine?
[1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine has a molecular weight of 373.65 g/mol, XLogP of 4.21, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine is sourced from PubChem (CID 106649782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).