[(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine

C10H11ClN4S — CID 105287302

IUPAC[(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
SMILESCc1nnsc1C(NN)c1ccccc1Cl
InChIInChI=1S/C10H11ClN4S/c1-6-10(16-15-14-6)9(13-12)7-4-2-3-5-8(7)11/h2-5,9,13H,12H2,1H3
InChIKeyKHAGXOKCBHGQNY-UHFFFAOYSA-N
MW254.75 g/mol
LogP2.05
Rot. Bonds3

About [(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine

[(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine (PubChem CID 105287302) has the molecular formula C10H11ClN4S and a molecular weight of 254.75 g/mol. Its IUPAC name is [(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
PubChem CID105287302
Molecular FormulaC10H11ClN4S
Molecular Weight254.75 g/mol
Exact Mass254.04
IUPAC Name[(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
SMILESCc1nnsc1C(NN)c1ccccc1Cl
InChIInChI=1S/C10H11ClN4S/c1-6-10(16-15-14-6)9(13-12)7-4-2-3-5-8(7)11/h2-5,9,13H,12H2,1H3
InChIKeyKHAGXOKCBHGQNY-UHFFFAOYSA-N
XLogP2.05
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.75
LogP ≤ 52.05
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-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The IUPAC name of [(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine (CID 105287302) is [(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine is Cc1nnsc1C(NN)c1ccccc1Cl.
What is the InChIKey of [(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The InChIKey is KHAGXOKCBHGQNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4S/c1-6-10(16-15-14-6)9(13-12)7-4-2-3-5-8(7)11/h2-5,9,13H,12H2,1H3.
What are the key properties of [(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
[(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine has a molecular weight of 254.75 g/mol, XLogP of 2.05, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105287302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).