[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine

C12H15FN4OS — CID 105334201

IUPAC[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2snnc2C)c1F
InChIInChI=1S/C12H15FN4OS/c1-7-12(19-17-16-7)9(15-14)6-8-4-3-5-10(18-2)11(8)13/h3-5,9,15H,6,14H2,1-2H3
InChIKeyYEODUGZAWVKEJT-UHFFFAOYSA-N
MW282.34 g/mol
LogP1.74
Rot. Bonds5

About [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine

[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine (PubChem CID 105334201) has the molecular formula C12H15FN4OS and a molecular weight of 282.34 g/mol. Its IUPAC name is [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
PubChem CID105334201
Molecular FormulaC12H15FN4OS
Molecular Weight282.34 g/mol
Exact Mass282.10
IUPAC Name[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
SMILESCOc1cccc(CC(NN)c2snnc2C)c1F
InChIInChI=1S/C12H15FN4OS/c1-7-12(19-17-16-7)9(15-14)6-8-4-3-5-10(18-2)11(8)13/h3-5,9,15H,6,14H2,1-2H3
InChIKeyYEODUGZAWVKEJT-UHFFFAOYSA-N
XLogP1.74
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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-methylphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
CID 105285141
[1-(2-chlorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105211219
[1-(3,5-difluorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105207998
[2-(2-methoxyphenyl)-1-(4-propan-2-ylthiadiazol-5-yl)ethyl]hydrazine
CID 105289507
[2-(2-fluoro-3-methoxyphenyl)-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105334210
N-[2-(2-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]propan-1-amine
CID 105107566
2-(2,3-difluorophenyl)-N-ethyl-1-(4-methylthiadiazol-5-yl)ethanamine
CID 105137731
[2-(2-fluoro-3-methoxyphenyl)-1-(1H-imidazol-2-yl)ethyl]hydrazine
CID 105252342
[1-(4-methylthiadiazol-5-yl)-2-phenylethyl]hydrazine
CID 105283044
[2-(5-bromo-2-fluorophenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine
CID 105294843
[1-(3-chlorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105194806
[2-(2-fluoro-3-methoxyphenyl)-1-(1-methylpyrazol-4-yl)ethyl]hydrazine
CID 105228535

Frequently Asked Questions

What is the IUPAC name of [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine (CID 105334201) is [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine is COc1cccc(CC(NN)c2snnc2C)c1F.
What is the InChIKey of [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine?
The InChIKey is YEODUGZAWVKEJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN4OS/c1-7-12(19-17-16-7)9(15-14)6-8-4-3-5-10(18-2)11(8)13/h3-5,9,15H,6,14H2,1-2H3.
What are the key properties of [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine?
[2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine has a molecular weight of 282.34 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluoro-3-methoxyphenyl)-1-(4-methylthiadiazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105334201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).