[4-(propoxymethyl)thiadiazol-5-yl]hydrazine

C6H12N4OS — CID 62244163

IUPAC[4-(propoxymethyl)thiadiazol-5-yl]hydrazine
SMILESCCCOCc1nnsc1NN
InChIInChI=1S/C6H12N4OS/c1-2-3-11-4-5-6(8-7)12-10-9-5/h8H,2-4,7H2,1H3
InChIKeyNUSPPZSKCMIHCP-UHFFFAOYSA-N
MW188.26 g/mol
LogP0.75
Rot. Bonds5

About [4-(propoxymethyl)thiadiazol-5-yl]hydrazine

[4-(propoxymethyl)thiadiazol-5-yl]hydrazine (PubChem CID 62244163) has the molecular formula C6H12N4OS and a molecular weight of 188.26 g/mol. Its IUPAC name is [4-(propoxymethyl)thiadiazol-5-yl]hydrazine.

Molecular Properties

Compound Name[4-(propoxymethyl)thiadiazol-5-yl]hydrazine
PubChem CID62244163
Molecular FormulaC6H12N4OS
Molecular Weight188.26 g/mol
Exact Mass188.07
IUPAC Name[4-(propoxymethyl)thiadiazol-5-yl]hydrazine
SMILESCCCOCc1nnsc1NN
InChIInChI=1S/C6H12N4OS/c1-2-3-11-4-5-6(8-7)12-10-9-5/h8H,2-4,7H2,1H3
InChIKeyNUSPPZSKCMIHCP-UHFFFAOYSA-N
XLogP0.75
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.26
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(propoxymethyl)thiadiazol-5-yl]hydrazine?
The IUPAC name of [4-(propoxymethyl)thiadiazol-5-yl]hydrazine (CID 62244163) is [4-(propoxymethyl)thiadiazol-5-yl]hydrazine.
What is the SMILES notation for [4-(propoxymethyl)thiadiazol-5-yl]hydrazine?
The canonical SMILES for [4-(propoxymethyl)thiadiazol-5-yl]hydrazine is CCCOCc1nnsc1NN.
What is the InChIKey of [4-(propoxymethyl)thiadiazol-5-yl]hydrazine?
The InChIKey is NUSPPZSKCMIHCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4OS/c1-2-3-11-4-5-6(8-7)12-10-9-5/h8H,2-4,7H2,1H3.
What are the key properties of [4-(propoxymethyl)thiadiazol-5-yl]hydrazine?
[4-(propoxymethyl)thiadiazol-5-yl]hydrazine has a molecular weight of 188.26 g/mol, XLogP of 0.75, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(propoxymethyl)thiadiazol-5-yl]hydrazine is sourced from PubChem (CID 62244163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).