[2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine

C13H14BrFN2O — CID 105269473

IUPAC[2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine
SMILESCc1ccoc1C(Cc1cc(F)ccc1Br)NN
InChIInChI=1S/C13H14BrFN2O/c1-8-4-5-18-13(8)12(17-16)7-9-6-10(15)2-3-11(9)14/h2-6,12,17H,7,16H2,1H3
InChIKeyGFOVLJZNDDUQRU-UHFFFAOYSA-N
MW313.17 g/mol
LogP3.24
Rot. Bonds4

About [2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine

[2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine (PubChem CID 105269473) has the molecular formula C13H14BrFN2O and a molecular weight of 313.17 g/mol. Its IUPAC name is [2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine
PubChem CID105269473
Molecular FormulaC13H14BrFN2O
Molecular Weight313.17 g/mol
Exact Mass312.03
IUPAC Name[2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine
SMILESCc1ccoc1C(Cc1cc(F)ccc1Br)NN
InChIInChI=1S/C13H14BrFN2O/c1-8-4-5-18-13(8)12(17-16)7-9-6-10(15)2-3-11(9)14/h2-6,12,17H,7,16H2,1H3
InChIKeyGFOVLJZNDDUQRU-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-bromo-4-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine
CID 105269345
2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethanamine
CID 113455206
[2-(3,5-difluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine
CID 105413007
[2-(2-bromo-5-fluorophenyl)-1-(3,5-difluorophenyl)ethyl]hydrazine
CID 105207928
N-[2-(2-bromo-4-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]propan-1-amine
CID 104805965
[2-(2-bromo-5-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethyl]hydrazine
CID 105297127
[2-(2-bromo-5-fluorophenyl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
CID 105261623
2-(2,5-difluorophenyl)-N-ethyl-1-(3-methylfuran-2-yl)ethanamine
CID 104805432
[2-(3,4-difluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine
CID 105269465
[2-(2-bromo-5-fluorophenyl)-1-(5-methylpyrazin-2-yl)ethyl]hydrazine
CID 105297058
[2-(2-bromo-5-fluorophenyl)-1-(2,4-dibromophenyl)ethyl]hydrazine
CID 107948135
[2-(2-bromo-5-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203759

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine (CID 105269473) is [2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine is Cc1ccoc1C(Cc1cc(F)ccc1Br)NN.
What is the InChIKey of [2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine?
The InChIKey is GFOVLJZNDDUQRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrFN2O/c1-8-4-5-18-13(8)12(17-16)7-9-6-10(15)2-3-11(9)14/h2-6,12,17H,7,16H2,1H3.
What are the key properties of [2-(2-bromo-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine?
[2-(2-bromo-5-fluorophenyl)-1-(3-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-5-fluorophenyl)-1-(3-methylfuran-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105269473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).