[2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine

C15H22BrFN2O — CID 105297482

IUPAC[2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
SMILESCC1OC(C)C(C(Cc2ccc(Br)cc2F)NN)C1C
InChIInChI=1S/C15H22BrFN2O/c1-8-9(2)20-10(3)15(8)14(19-18)6-11-4-5-12(16)7-13(11)17/h4-5,7-10,14-15,19H,6,18H2,1-3H3
InChIKeyDLZDXNAZYOMIAF-UHFFFAOYSA-N
MW345.26 g/mol
LogP3.02
Rot. Bonds4

About [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine

[2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine (PubChem CID 105297482) has the molecular formula C15H22BrFN2O and a molecular weight of 345.26 g/mol. Its IUPAC name is [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
PubChem CID105297482
Molecular FormulaC15H22BrFN2O
Molecular Weight345.26 g/mol
Exact Mass344.09
IUPAC Name[2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
SMILESCC1OC(C)C(C(Cc2ccc(Br)cc2F)NN)C1C
InChIInChI=1S/C15H22BrFN2O/c1-8-9(2)20-10(3)15(8)14(19-18)6-11-4-5-12(16)7-13(11)17/h4-5,7-10,14-15,19H,6,18H2,1-3H3
InChIKeyDLZDXNAZYOMIAF-UHFFFAOYSA-N
XLogP3.02
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.26
LogP ≤ 53.02
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-(2-bromophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
CID 105283970
[2-(5-bromothiophen-2-yl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
CID 105295808
[2-phenyl-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
CID 105283188
[2-(4-bromo-2-fluorophenyl)-1-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105297423
[1-(4-bromo-2-fluorophenyl)-3-ethylsulfanylpropan-2-yl]hydrazine
CID 105225209
[2-(4-bromo-2-fluorophenyl)-1-(5-bromo-2-methylphenyl)ethyl]hydrazine
CID 105297391
[2-pyridin-3-yl-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine
CID 105333771
[2-(4-bromo-2-fluorophenyl)-1-(2,4-dibromophenyl)ethyl]hydrazine
CID 107948139
2-(3-bromophenyl)-N-ethyl-1-(2,4,5-trimethyloxolan-3-yl)ethanamine
CID 65155889
3-[(4-bromo-2-fluorophenyl)methyl]pentan-2-amine
CID 61000121
[1-(4-bromo-2-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 105297513
1-(4-bromo-2-fluorophenyl)-N-methyl-3-methylsulfanylpropan-2-amine
CID 62694239

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine (CID 105297482) is [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine is CC1OC(C)C(C(Cc2ccc(Br)cc2F)NN)C1C.
What is the InChIKey of [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine?
The InChIKey is DLZDXNAZYOMIAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22BrFN2O/c1-8-9(2)20-10(3)15(8)14(19-18)6-11-4-5-12(16)7-13(11)17/h4-5,7-10,14-15,19H,6,18H2,1-3H3.
What are the key properties of [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine?
[2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine has a molecular weight of 345.26 g/mol, XLogP of 3.02, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromo-2-fluorophenyl)-1-(2,4,5-trimethyloxolan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105297482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).