[(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine

C11H12F2N4S — CID 105301889

IUPAC[(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
SMILESCCc1nnsc1C(NN)c1cc(F)cc(F)c1
InChIInChI=1S/C11H12F2N4S/c1-2-9-11(18-17-16-9)10(15-14)6-3-7(12)5-8(13)4-6/h3-5,10,15H,2,14H2,1H3
InChIKeyDKQMXMNESLELFN-UHFFFAOYSA-N
MW270.31 g/mol
LogP1.93
Rot. Bonds4

About [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine

[(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine (PubChem CID 105301889) has the molecular formula C11H12F2N4S and a molecular weight of 270.31 g/mol. Its IUPAC name is [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
PubChem CID105301889
Molecular FormulaC11H12F2N4S
Molecular Weight270.31 g/mol
Exact Mass270.08
IUPAC Name[(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
SMILESCCc1nnsc1C(NN)c1cc(F)cc(F)c1
InChIInChI=1S/C11H12F2N4S/c1-2-9-11(18-17-16-9)10(15-14)6-3-7(12)5-8(13)4-6/h3-5,10,15H,2,14H2,1H3
InChIKeyDKQMXMNESLELFN-UHFFFAOYSA-N
XLogP1.93
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 51.93
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

[(4-ethylthiadiazol-5-yl)-(furan-3-yl)methyl]hydrazine
CID 105305908
1-(3,5-dimethylphenyl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
CID 105096803
[(3-cyclobutylphenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105342036
[(4-ethylthiadiazol-5-yl)-(5-methylthiophen-2-yl)methyl]hydrazine
CID 105318787
[(3-cyclopropyloxyphenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105341171
[2-(2-bromo-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethyl]hydrazine
CID 105297089
N-[(3-fluoro-5-methylphenyl)-(4-propylthiadiazol-5-yl)methyl]propan-1-amine
CID 105170013
[(4-ethylthiadiazol-5-yl)-pyrazin-2-ylmethyl]hydrazine
CID 105308737
[(1-ethylimidazol-2-yl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105308543
[1-(4-ethylthiadiazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340893
[(5-fluoro-3-pyridinyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105288008
[(4-ethylthiadiazol-5-yl)-[4-(trifluoromethyl)-3-pyridinyl]methyl]hydrazine
CID 102710567

Frequently Asked Questions

What is the IUPAC name of [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine?
The IUPAC name of [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine (CID 105301889) is [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine is CCc1nnsc1C(NN)c1cc(F)cc(F)c1.
What is the InChIKey of [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine?
The InChIKey is DKQMXMNESLELFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12F2N4S/c1-2-9-11(18-17-16-9)10(15-14)6-3-7(12)5-8(13)4-6/h3-5,10,15H,2,14H2,1H3.
What are the key properties of [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine?
[(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine has a molecular weight of 270.31 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-difluorophenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105301889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).