[1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine

C9H18N4S — CID 105325816

IUPAC[1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine
SMILESCCc1nnsc1C(NN)C(C)CC
InChIInChI=1S/C9H18N4S/c1-4-6(3)8(11-10)9-7(5-2)12-13-14-9/h6,8,11H,4-5,10H2,1-3H3
InChIKeyUWQWPELOFDYQKV-UHFFFAOYSA-N
MW214.34 g/mol
LogP1.65
Rot. Bonds5

About [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine

[1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine (PubChem CID 105325816) has the molecular formula C9H18N4S and a molecular weight of 214.34 g/mol. Its IUPAC name is [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine
PubChem CID105325816
Molecular FormulaC9H18N4S
Molecular Weight214.34 g/mol
Exact Mass214.13
IUPAC Name[1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine
SMILESCCc1nnsc1C(NN)C(C)CC
InChIInChI=1S/C9H18N4S/c1-4-6(3)8(11-10)9-7(5-2)12-13-14-9/h6,8,11H,4-5,10H2,1-3H3
InChIKeyUWQWPELOFDYQKV-UHFFFAOYSA-N
XLogP1.65
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.34
LogP ≤ 51.65
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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Frequently Asked Questions

What is the IUPAC name of [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine?
The IUPAC name of [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine (CID 105325816) is [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine.
What is the SMILES notation for [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine?
The canonical SMILES for [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine is CCc1nnsc1C(NN)C(C)CC.
What is the InChIKey of [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine?
The InChIKey is UWQWPELOFDYQKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4S/c1-4-6(3)8(11-10)9-7(5-2)12-13-14-9/h6,8,11H,4-5,10H2,1-3H3.
What are the key properties of [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine?
[1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine has a molecular weight of 214.34 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-ethylthiadiazol-5-yl)-2-methylbutyl]hydrazine is sourced from PubChem (CID 105325816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).