[4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine

C8H16N4OS — CID 62244519

IUPAC[4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine
SMILESCCC(C)(C)OCc1nnsc1NN
InChIInChI=1S/C8H16N4OS/c1-4-8(2,3)13-5-6-7(10-9)14-12-11-6/h10H,4-5,9H2,1-3H3
InChIKeyNMVSKSIQLXTZAR-UHFFFAOYSA-N
MW216.31 g/mol
LogP1.53
Rot. Bonds5

About [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine

[4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine (PubChem CID 62244519) has the molecular formula C8H16N4OS and a molecular weight of 216.31 g/mol. Its IUPAC name is [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine.

Molecular Properties

Compound Name[4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine
PubChem CID62244519
Molecular FormulaC8H16N4OS
Molecular Weight216.31 g/mol
Exact Mass216.10
IUPAC Name[4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine
SMILESCCC(C)(C)OCc1nnsc1NN
InChIInChI=1S/C8H16N4OS/c1-4-8(2,3)13-5-6-7(10-9)14-12-11-6/h10H,4-5,9H2,1-3H3
InChIKeyNMVSKSIQLXTZAR-UHFFFAOYSA-N
XLogP1.53
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.31
LogP ≤ 51.53
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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Frequently Asked Questions

What is the IUPAC name of [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine?
The IUPAC name of [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine (CID 62244519) is [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine.
What is the SMILES notation for [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine?
The canonical SMILES for [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine is CCC(C)(C)OCc1nnsc1NN.
What is the InChIKey of [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine?
The InChIKey is NMVSKSIQLXTZAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4OS/c1-4-8(2,3)13-5-6-7(10-9)14-12-11-6/h10H,4-5,9H2,1-3H3.
What are the key properties of [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine?
[4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine has a molecular weight of 216.31 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methylbutan-2-yloxymethyl)thiadiazol-5-yl]hydrazine is sourced from PubChem (CID 62244519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).