[(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine

C11H14N4O2S — CID 105301107

IUPAC[(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2cnsn2)cc1OC
InChIInChI=1S/C11H14N4O2S/c1-16-9-4-3-7(5-10(9)17-2)11(14-12)8-6-13-18-15-8/h3-6,11,14H,12H2,1-2H3
InChIKeyUSZQZRGQSAUDBN-UHFFFAOYSA-N
MW266.33 g/mol
LogP1.11
Rot. Bonds5

About [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine

[(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine (PubChem CID 105301107) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine
PubChem CID105301107
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC Name[(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2cnsn2)cc1OC
InChIInChI=1S/C11H14N4O2S/c1-16-9-4-3-7(5-10(9)17-2)11(14-12)8-6-13-18-15-8/h3-6,11,14H,12H2,1-2H3
InChIKeyUSZQZRGQSAUDBN-UHFFFAOYSA-N
XLogP1.11
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105192317
[(3,4-dimethoxyphenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105192250
N-[(3,4-diethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]ethanamine
CID 105143439
[(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 107979050
[(1-ethyl-4-methoxypyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine
CID 105339368
[(3,4-dimethoxyphenyl)-(3-methoxypyrazin-2-yl)methyl]hydrazine
CID 105192205
[(4-methoxy-1-propylpyrazol-5-yl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine
CID 105339799
[1,2,5-thiadiazol-3-yl-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105301323
[(4-chloro-3-methoxyphenyl)-(6-methoxypyridazin-3-yl)methyl]hydrazine
CID 103375610
N-[(2-methoxy-5-methylphenyl)-(1,2,5-thiadiazol-3-yl)methyl]ethanamine
CID 105144099
[(2,4-dichlorophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105301093
[(4-chloro-1-ethylpyrazol-5-yl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105192162

Frequently Asked Questions

What is the IUPAC name of [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine?
The IUPAC name of [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine (CID 105301107) is [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine.
What is the SMILES notation for [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine?
The canonical SMILES for [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine is COc1ccc(C(NN)c2cnsn2)cc1OC.
What is the InChIKey of [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine?
The InChIKey is USZQZRGQSAUDBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-16-9-4-3-7(5-10(9)17-2)11(14-12)8-6-13-18-15-8/h3-6,11,14H,12H2,1-2H3.
What are the key properties of [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine?
[(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine has a molecular weight of 266.33 g/mol, XLogP of 1.11, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,4-dimethoxyphenyl)-(1,2,5-thiadiazol-3-yl)methyl]hydrazine is sourced from PubChem (CID 105301107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).