[(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine

C12H16N4OS — CID 105327992

IUPAC[(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
SMILESCCOc1cccc(C(NN)c2snnc2C)c1
InChIInChI=1S/C12H16N4OS/c1-3-17-10-6-4-5-9(7-10)11(14-13)12-8(2)15-16-18-12/h4-7,11,14H,3,13H2,1-2H3
InChIKeyIWGUZNSOJLVCHM-UHFFFAOYSA-N
MW264.35 g/mol
LogP1.80
Rot. Bonds5

About [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine

[(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine (PubChem CID 105327992) has the molecular formula C12H16N4OS and a molecular weight of 264.35 g/mol. Its IUPAC name is [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
PubChem CID105327992
Molecular FormulaC12H16N4OS
Molecular Weight264.35 g/mol
Exact Mass264.10
IUPAC Name[(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
SMILESCCOc1cccc(C(NN)c2snnc2C)c1
InChIInChI=1S/C12H16N4OS/c1-3-17-10-6-4-5-9(7-10)11(14-13)12-8(2)15-16-18-12/h4-7,11,14H,3,13H2,1-2H3
InChIKeyIWGUZNSOJLVCHM-UHFFFAOYSA-N
XLogP1.80
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 51.80
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

[(3-ethoxyphenyl)-pyrimidin-2-ylmethyl]hydrazine
CID 105203562
[(4-methylthiadiazol-5-yl)-(5-propoxy-3-pyridinyl)methyl]hydrazine
CID 105330043
N-[(3-cyclopropyloxyphenyl)-(4-methylthiadiazol-5-yl)methyl]ethanamine
CID 105188592
[(3-ethoxyphenyl)-(3-propylphenyl)methyl]hydrazine
CID 105192042
[(3-cyclopropyloxyphenyl)-(4-ethylthiadiazol-5-yl)methyl]hydrazine
CID 105341171
[(2-bromo-3-methylphenyl)-(3-ethoxyphenyl)methyl]hydrazine
CID 107986143
[(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine
CID 105191931
N-[(4-methylthiadiazol-5-yl)-[3-(trifluoromethoxy)phenyl]methyl]ethanamine
CID 105145860
[(3-chloro-2-methylphenyl)-(3-ethoxyphenyl)methyl]hydrazine
CID 107103783
[(3,4-dichlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105281260
[(3-ethoxyphenyl)-(2-ethyl-5-methylpyrazol-3-yl)methyl]hydrazine
CID 105328071
[(4-methylthiadiazol-5-yl)-quinolin-3-ylmethyl]hydrazine
CID 105286857

Frequently Asked Questions

What is the IUPAC name of [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The IUPAC name of [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine (CID 105327992) is [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine is CCOc1cccc(C(NN)c2snnc2C)c1.
What is the InChIKey of [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The InChIKey is IWGUZNSOJLVCHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4OS/c1-3-17-10-6-4-5-9(7-10)11(14-13)12-8(2)15-16-18-12/h4-7,11,14H,3,13H2,1-2H3.
What are the key properties of [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
[(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine has a molecular weight of 264.35 g/mol, XLogP of 1.80, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105327992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).