[2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine

C12H14F2N4S — CID 105342906

IUPAC[2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
SMILESCCc1nnsc1C(Cc1c(F)cccc1F)NN
InChIInChI=1S/C12H14F2N4S/c1-2-10-12(19-18-17-10)11(16-15)6-7-8(13)4-3-5-9(7)14/h3-5,11,16H,2,6,15H2,1H3
InChIKeyXRNRMCFYESTFTG-UHFFFAOYSA-N
MW284.33 g/mol
LogP2.13
Rot. Bonds5

About [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine

[2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine (PubChem CID 105342906) has the molecular formula C12H14F2N4S and a molecular weight of 284.33 g/mol. Its IUPAC name is [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
PubChem CID105342906
Molecular FormulaC12H14F2N4S
Molecular Weight284.33 g/mol
Exact Mass284.09
IUPAC Name[2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
SMILESCCc1nnsc1C(Cc1c(F)cccc1F)NN
InChIInChI=1S/C12H14F2N4S/c1-2-10-12(19-18-17-10)11(16-15)6-7-8(13)4-3-5-9(7)14/h3-5,11,16H,2,6,15H2,1H3
InChIKeyXRNRMCFYESTFTG-UHFFFAOYSA-N
XLogP2.13
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 52.13
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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Frequently Asked Questions

What is the IUPAC name of [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine?
The IUPAC name of [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine (CID 105342906) is [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine is CCc1nnsc1C(Cc1c(F)cccc1F)NN.
What is the InChIKey of [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine?
The InChIKey is XRNRMCFYESTFTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F2N4S/c1-2-10-12(19-18-17-10)11(16-15)6-7-8(13)4-3-5-9(7)14/h3-5,11,16H,2,6,15H2,1H3.
What are the key properties of [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine?
[2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine has a molecular weight of 284.33 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,6-difluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105342906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).