[2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine

C13H14BrFN2O — CID 105296699

IUPAC[2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
SMILESCc1ccc(C(Cc2ccc(F)cc2Br)NN)o1
InChIInChI=1S/C13H14BrFN2O/c1-8-2-5-13(18-8)12(17-16)6-9-3-4-10(15)7-11(9)14/h2-5,7,12,17H,6,16H2,1H3
InChIKeyMINFTQFNBNRQIB-UHFFFAOYSA-N
MW313.17 g/mol
LogP3.24
Rot. Bonds4

About [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine

[2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine (PubChem CID 105296699) has the molecular formula C13H14BrFN2O and a molecular weight of 313.17 g/mol. Its IUPAC name is [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
PubChem CID105296699
Molecular FormulaC13H14BrFN2O
Molecular Weight313.17 g/mol
Exact Mass312.03
IUPAC Name[2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
SMILESCc1ccc(C(Cc2ccc(F)cc2Br)NN)o1
InChIInChI=1S/C13H14BrFN2O/c1-8-2-5-13(18-8)12(17-16)6-9-3-4-10(15)7-11(9)14/h2-5,7,12,17H,6,16H2,1H3
InChIKeyMINFTQFNBNRQIB-UHFFFAOYSA-N
XLogP3.24
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.17
LogP ≤ 53.24
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-chloro-5-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 102623484
[2-(5-bromo-2-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 105294948
[2-(2-bromo-4-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine
CID 105269345
[2-(4-bromo-2-chlorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 105335235
2-(2-bromo-4-fluorophenyl)-1-(5-chlorofuran-2-yl)-N-methylethanamine
CID 106691787
[2-(2-bromo-4-fluorophenyl)-1-(4-propan-2-ylphenyl)ethyl]hydrazine
CID 105194059
[2-(2-bromo-4-fluorophenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105204048
2-(2-bromo-5-fluorophenyl)-N-ethyl-1-(5-methylfuran-2-yl)ethanamine
CID 115843716
[1-(3-bromo-4-chlorophenyl)-2-(2-bromo-4-fluorophenyl)ethyl]hydrazine
CID 105260939
[2-(2-bromo-4-fluorophenyl)-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
CID 105261810
[2-(2-bromo-4-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203629
[1-(2-bromo-4-fluorophenyl)-3,3-dimethylbutan-2-yl]hydrazine
CID 105202997

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine (CID 105296699) is [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine is Cc1ccc(C(Cc2ccc(F)cc2Br)NN)o1.
What is the InChIKey of [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine?
The InChIKey is MINFTQFNBNRQIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrFN2O/c1-8-2-5-13(18-8)12(17-16)6-9-3-4-10(15)7-11(9)14/h2-5,7,12,17H,6,16H2,1H3.
What are the key properties of [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine?
[2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine has a molecular weight of 313.17 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-4-fluorophenyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105296699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).