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

C12H14BrFN4S — CID 105297089

IUPAC[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
SMILESCCc1nnsc1C(Cc1cc(F)ccc1Br)NN
InChIInChI=1S/C12H14BrFN4S/c1-2-10-12(19-18-17-10)11(16-15)6-7-5-8(14)3-4-9(7)13/h3-5,11,16H,2,6,15H2,1H3
InChIKeyIADLDROUKDDOSA-UHFFFAOYSA-N
MW345.24 g/mol
LogP2.75
Rot. Bonds5

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

[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine (PubChem CID 105297089) has the molecular formula C12H14BrFN4S and a molecular weight of 345.24 g/mol. Its IUPAC name is [2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
PubChem CID105297089
Molecular FormulaC12H14BrFN4S
Molecular Weight345.24 g/mol
Exact Mass344.01
IUPAC Name[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
SMILESCCc1nnsc1C(Cc1cc(F)ccc1Br)NN
InChIInChI=1S/C12H14BrFN4S/c1-2-10-12(19-18-17-10)11(16-15)6-7-5-8(14)3-4-9(7)13/h3-5,11,16H,2,6,15H2,1H3
InChIKeyIADLDROUKDDOSA-UHFFFAOYSA-N
XLogP2.75
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.24
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

N-[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]propan-1-amine
CID 105136841
[1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340893
2-(2-bromo-5-fluorophenyl)-N-ethyl-1-(4-methylthiadiazol-5-yl)ethanamine
CID 105136734
2-(2-bromo-4-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethanol
CID 105087909
[2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
CID 105342906
[2-(2-bromo-5-fluorophenyl)-1-(3-methoxythiophen-2-yl)ethyl]hydrazine
CID 105297119
[2-(2-bromo-5-fluorophenyl)-1-(3,5-difluorophenyl)ethyl]hydrazine
CID 105207928
[2-(2-bromo-5-fluorophenyl)-1-pyrimidin-2-ylethyl]hydrazine
CID 105203759
[2-(2-bromo-5-fluorophenyl)-1-(5-methylpyrimidin-2-yl)ethyl]hydrazine
CID 105261623
[2-(2,3-dihydro-1H-inden-5-yl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
CID 105310750
[2-(2-bromo-5-fluorophenyl)-1-(5-bromothiophen-3-yl)ethyl]hydrazine
CID 105297094
2-(2-bromo-5-fluorophenyl)-1-(4-propan-2-ylthiadiazol-5-yl)ethanol
CID 105088383

Frequently Asked Questions

What is the IUPAC name of [2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine (CID 105297089) is [2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine is CCc1nnsc1C(Cc1cc(F)ccc1Br)NN.
What is the InChIKey of [2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine?
The InChIKey is IADLDROUKDDOSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14BrFN4S/c1-2-10-12(19-18-17-10)11(16-15)6-7-5-8(14)3-4-9(7)13/h3-5,11,16H,2,6,15H2,1H3.
What are the key properties of [2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine?
[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine has a molecular weight of 345.24 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105297089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).