[1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine

C13H17FN4S — CID 105340893

IUPAC[1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
SMILESCCc1nnsc1C(Cc1ccc(F)cc1C)NN
InChIInChI=1S/C13H17FN4S/c1-3-11-13(19-18-17-11)12(16-15)7-9-4-5-10(14)6-8(9)2/h4-6,12,16H,3,7,15H2,1-2H3
InChIKeyPGITZJIAHKJRIB-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.30
Rot. Bonds5

About [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine

[1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine (PubChem CID 105340893) has the molecular formula C13H17FN4S and a molecular weight of 280.37 g/mol. Its IUPAC name is [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
PubChem CID105340893
Molecular FormulaC13H17FN4S
Molecular Weight280.37 g/mol
Exact Mass280.12
IUPAC Name[1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
SMILESCCc1nnsc1C(Cc1ccc(F)cc1C)NN
InChIInChI=1S/C13H17FN4S/c1-3-11-13(19-18-17-11)12(16-15)7-9-4-5-10(14)6-8(9)2/h4-6,12,16H,3,7,15H2,1-2H3
InChIKeyPGITZJIAHKJRIB-UHFFFAOYSA-N
XLogP2.30
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.30
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

[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
CID 105297089
[1-(4-tert-butylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340927
[2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
CID 105342906
2-(4-fluoro-2-methylphenyl)-1-(4-propylthiadiazol-5-yl)ethanol
CID 105131314
[2-(2,3-dihydro-1H-inden-5-yl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
CID 105310750
N-[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]propan-1-amine
CID 105136841
2-(2-bromo-4-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethanol
CID 105087909
[1-(4-tert-butylthiadiazol-5-yl)-2-(2-chloro-4-fluorophenyl)ethyl]hydrazine
CID 105295283
[1-(4-ethylthiadiazol-5-yl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105324673
[(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105301889
[2-(2-methylphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
CID 105285141
[2-(4-fluoro-2-methylphenyl)-1-pyridazin-4-ylethyl]hydrazine
CID 105340852

Frequently Asked Questions

What is the IUPAC name of [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine (CID 105340893) is [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine is CCc1nnsc1C(Cc1ccc(F)cc1C)NN.
What is the InChIKey of [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine?
The InChIKey is PGITZJIAHKJRIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN4S/c1-3-11-13(19-18-17-11)12(16-15)7-9-4-5-10(14)6-8(9)2/h4-6,12,16H,3,7,15H2,1-2H3.
What are the key properties of [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine?
[1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine has a molecular weight of 280.37 g/mol, XLogP of 2.30, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105340893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).