[1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine

C15H15BrClFN2O — CID 105296649

IUPAC[1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine
SMILESNNC(COc1ccc(Cl)cc1)Cc1ccc(F)cc1Br
InChIInChI=1S/C15H15BrClFN2O/c16-15-8-12(18)4-1-10(15)7-13(20-19)9-21-14-5-2-11(17)3-6-14/h1-6,8,13,20H,7,9,19H2
InChIKeySRGGLIXNAPSSAY-UHFFFAOYSA-N
MW373.65 g/mol
LogP3.69
Rot. Bonds6

About [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine

[1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine (PubChem CID 105296649) has the molecular formula C15H15BrClFN2O and a molecular weight of 373.65 g/mol. Its IUPAC name is [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine
PubChem CID105296649
Molecular FormulaC15H15BrClFN2O
Molecular Weight373.65 g/mol
Exact Mass372.00
IUPAC Name[1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine
SMILESNNC(COc1ccc(Cl)cc1)Cc1ccc(F)cc1Br
InChIInChI=1S/C15H15BrClFN2O/c16-15-8-12(18)4-1-10(15)7-13(20-19)9-21-14-5-2-11(17)3-6-14/h1-6,8,13,20H,7,9,19H2
InChIKeySRGGLIXNAPSSAY-UHFFFAOYSA-N
XLogP3.69
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.65
LogP ≤ 53.69
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

[1-(4-chlorophenoxy)-3-(2,5-dichlorophenyl)propan-2-yl]hydrazine
CID 105309838
2-bromo-1-[(4-chlorophenoxy)methyl]-4-fluorobenzene
CID 63457531
[1-(4-chlorophenoxy)-3-(3,4-difluorophenyl)propan-2-yl]hydrazine
CID 105330358
[1-(2-bromo-4-fluorophenyl)-3-(2,2,3,3-tetrafluoropropoxy)propan-2-yl]hydrazine
CID 103477734
[1-(4-chlorophenoxy)-3-(4-ethylphenyl)propan-2-yl]hydrazine
CID 105287885
1-(2-bromo-4-fluorophenyl)-3-phenoxypropan-2-amine
CID 62717569
[1-(2-bromophenyl)-3-(4-chloro-2-fluorophenyl)propan-2-yl]hydrazine
CID 105214935
[1-(2-bromo-4-fluorophenyl)-4-ethoxybutan-2-yl]hydrazine
CID 105296727
[1-(2-bromo-4-fluorophenyl)-3-methylsulfonylpropan-2-yl]hydrazine
CID 105296748
[1-(3-bromo-2,6-difluorophenyl)-3-phenoxypropan-2-yl]hydrazine
CID 106270864
[1-(4-bromo-2-fluorophenyl)-3-(2-chloro-4-fluorophenyl)propan-2-yl]hydrazine
CID 105216081
[1-(2-bromo-4-fluorophenyl)-3-ethylsulfanylpropan-2-yl]hydrazine
CID 105225306

Frequently Asked Questions

What is the IUPAC name of [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine?
The IUPAC name of [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine (CID 105296649) is [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine?
The canonical SMILES for [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine is NNC(COc1ccc(Cl)cc1)Cc1ccc(F)cc1Br.
What is the InChIKey of [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine?
The InChIKey is SRGGLIXNAPSSAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClFN2O/c16-15-8-12(18)4-1-10(15)7-13(20-19)9-21-14-5-2-11(17)3-6-14/h1-6,8,13,20H,7,9,19H2.
What are the key properties of [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine?
[1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine has a molecular weight of 373.65 g/mol, XLogP of 3.69, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-bromo-4-fluorophenyl)-3-(4-chlorophenoxy)propan-2-yl]hydrazine is sourced from PubChem (CID 105296649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).