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

C12H16N4S — CID 105304599

IUPAC[(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2snnc2C)c(C)c1
InChIInChI=1S/C12H16N4S/c1-7-4-5-10(8(2)6-7)11(14-13)12-9(3)15-16-17-12/h4-6,11,14H,13H2,1-3H3
InChIKeyCISNXWJEVWCJCD-UHFFFAOYSA-N
MW248.35 g/mol
LogP2.02
Rot. Bonds3

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

[(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine (PubChem CID 105304599) has the molecular formula C12H16N4S and a molecular weight of 248.35 g/mol. Its IUPAC name is [(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
PubChem CID105304599
Molecular FormulaC12H16N4S
Molecular Weight248.35 g/mol
Exact Mass248.11
IUPAC Name[(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
SMILESCc1ccc(C(NN)c2snnc2C)c(C)c1
InChIInChI=1S/C12H16N4S/c1-7-4-5-10(8(2)6-7)11(14-13)12-9(3)15-16-17-12/h4-6,11,14H,13H2,1-3H3
InChIKeyCISNXWJEVWCJCD-UHFFFAOYSA-N
XLogP2.02
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 52.02
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-methylthiadiazol-5-yl)-(2-methylthiophen-3-yl)methyl]hydrazine
CID 102843321
[(2-chlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105287302
[(2,4-dimethylphenyl)-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 105228647
[(3,4-dichlorophenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105281260
1-(2,4-dimethylphenyl)-N-methyl-1-(4-propylthiadiazol-5-yl)methanamine
CID 105145197
[(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105291606
[(2,4-dimethylphenyl)-quinoxalin-2-ylmethyl]hydrazine
CID 107357864
[(6-methyl-3-pyridinyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105305420
[(3-ethoxyphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105327992
[(4-methylthiadiazol-5-yl)-quinolin-3-ylmethyl]hydrazine
CID 105286857
[(2,4-dimethylphenyl)-(2-iodophenyl)methyl]hydrazine
CID 105304663
[(5-fluoro-3-pyridinyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine
CID 105288008

Frequently Asked Questions

What is the IUPAC name of [(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The IUPAC name of [(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine (CID 105304599) is [(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine is Cc1ccc(C(NN)c2snnc2C)c(C)c1.
What is the InChIKey of [(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The InChIKey is CISNXWJEVWCJCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4S/c1-7-4-5-10(8(2)6-7)11(14-13)12-9(3)15-16-17-12/h4-6,11,14H,13H2,1-3H3.
What are the key properties of [(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine?
[(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine has a molecular weight of 248.35 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-dimethylphenyl)-(4-methylthiadiazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105304599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).