[4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine

C9H9ClN4OS — CID 62244126

IUPAC[4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine
SMILESNNc1snnc1COc1ccccc1Cl
InChIInChI=1S/C9H9ClN4OS/c10-6-3-1-2-4-8(6)15-5-7-9(12-11)16-14-13-7/h1-4,12H,5,11H2
InChIKeyKQENQZGGYXYECJ-UHFFFAOYSA-N
MW256.72 g/mol
LogP2.06
Rot. Bonds4

About [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine

[4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine (PubChem CID 62244126) has the molecular formula C9H9ClN4OS and a molecular weight of 256.72 g/mol. Its IUPAC name is [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine.

Molecular Properties

Compound Name[4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine
PubChem CID62244126
Molecular FormulaC9H9ClN4OS
Molecular Weight256.72 g/mol
Exact Mass256.02
IUPAC Name[4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine
SMILESNNc1snnc1COc1ccccc1Cl
InChIInChI=1S/C9H9ClN4OS/c10-6-3-1-2-4-8(6)15-5-7-9(12-11)16-14-13-7/h1-4,12H,5,11H2
InChIKeyKQENQZGGYXYECJ-UHFFFAOYSA-N
XLogP2.06
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.72
LogP ≤ 52.06
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

4-[(2-chlorophenoxy)methyl]-N-methylthiadiazol-5-amine
CID 62193700
4-[(2-chlorophenoxy)methyl]thiadiazol-5-amine
CID 62193343
[5-[(2-chlorophenoxy)methyl]-1,3,4-oxadiazol-2-yl]hydrazine
CID 35754836
[4-[(3-methylphenoxy)methyl]thiadiazol-5-yl]hydrazine
CID 62244685
[4-[(2,3,5-trimethylphenoxy)methyl]thiadiazol-5-yl]hydrazine
CID 62245263
N-methyl-4-[(2-propoxyphenoxy)methyl]thiadiazol-5-amine
CID 62193214
[4-[(4-methylsulfanylphenoxy)methyl]thiadiazol-5-yl]hydrazine
CID 63648232
2-[[5-(propylamino)thiadiazol-4-yl]methoxy]benzamide
CID 62195489
N-methyl-4-[(2-methylsulfanylphenoxy)methyl]thiadiazol-5-amine
CID 55246729
4-[(4-bromo-2-chlorophenoxy)methyl]-N-ethylthiadiazol-5-amine
CID 62193786
5-chloro-4-[(2-methylsulfanylphenoxy)methyl]thiadiazole
CID 63649178
5-[(2-chlorophenoxy)methyl]thiophene-2-carbohydrazide
CID 55212226

Frequently Asked Questions

What is the IUPAC name of [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine?
The IUPAC name of [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine (CID 62244126) is [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine.
What is the SMILES notation for [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine?
The canonical SMILES for [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine is NNc1snnc1COc1ccccc1Cl.
What is the InChIKey of [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine?
The InChIKey is KQENQZGGYXYECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN4OS/c10-6-3-1-2-4-8(6)15-5-7-9(12-11)16-14-13-7/h1-4,12H,5,11H2.
What are the key properties of [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine?
[4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine has a molecular weight of 256.72 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-chlorophenoxy)methyl]thiadiazol-5-yl]hydrazine is sourced from PubChem (CID 62244126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).