[(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine

C14H20N4O2S — CID 105305151

IUPAC[(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine
SMILESCOc1ccc(OC)c(C(NN)c2snnc2C(C)C)c1
InChIInChI=1S/C14H20N4O2S/c1-8(2)12-14(21-18-17-12)13(16-15)10-7-9(19-3)5-6-11(10)20-4/h5-8,13,16H,15H2,1-4H3
InChIKeyWEXGIZNAJSBXGY-UHFFFAOYSA-N
MW308.41 g/mol
LogP2.23
Rot. Bonds6

About [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine

[(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine (PubChem CID 105305151) has the molecular formula C14H20N4O2S and a molecular weight of 308.41 g/mol. Its IUPAC name is [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine
PubChem CID105305151
Molecular FormulaC14H20N4O2S
Molecular Weight308.41 g/mol
Exact Mass308.13
IUPAC Name[(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine
SMILESCOc1ccc(OC)c(C(NN)c2snnc2C(C)C)c1
InChIInChI=1S/C14H20N4O2S/c1-8(2)12-14(21-18-17-12)13(16-15)10-7-9(19-3)5-6-11(10)20-4/h5-8,13,16H,15H2,1-4H3
InChIKeyWEXGIZNAJSBXGY-UHFFFAOYSA-N
XLogP2.23
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.41
LogP ≤ 52.23
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

[(2-fluorophenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine
CID 105292443
[(2,5-dimethoxyphenyl)-(2-methyl-1,3-thiazol-4-yl)methyl]hydrazine
CID 105305100
1-(2,5-dimethoxyphenyl)-1-(4-ethylthiadiazol-5-yl)-N-methylmethanamine
CID 105145714
[(2,5-dimethoxyphenyl)-thiophen-3-ylmethyl]hydrazine
CID 105196872
(5-fluoro-2-methoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methanamine
CID 105176488
[(2,5-dimethoxyphenyl)-(3-methyl-2-pyridinyl)methyl]hydrazine
CID 105209313
[(3,5-dichloro-2-pyridinyl)-(2,5-dimethoxyphenyl)methyl]hydrazine
CID 105248774
[1-(2,5-dimethoxyphenyl)-2-methylpropyl]hydrazine
CID 105199640
(4-methoxy-2-methylphenyl)-(4-propan-2-ylthiadiazol-5-yl)methanol
CID 105082992
1-(4-methoxy-2,5-dimethylphenyl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine
CID 105179103
[(4-ethylthiadiazol-5-yl)-(4-methoxy-2-methylphenyl)methyl]hydrazine
CID 105291606
[(2,5-dimethoxyphenyl)-(4-ethylphenyl)methyl]hydrazine
CID 105197445

Frequently Asked Questions

What is the IUPAC name of [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine?
The IUPAC name of [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine (CID 105305151) is [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine?
The canonical SMILES for [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine is COc1ccc(OC)c(C(NN)c2snnc2C(C)C)c1.
What is the InChIKey of [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine?
The InChIKey is WEXGIZNAJSBXGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2S/c1-8(2)12-14(21-18-17-12)13(16-15)10-7-9(19-3)5-6-11(10)20-4/h5-8,13,16H,15H2,1-4H3.
What are the key properties of [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine?
[(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine has a molecular weight of 308.41 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,5-dimethoxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105305151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).