1-(thiadiazol-4-yl)octylhydrazine

C10H20N4S — CID 105293500

IUPAC1-(thiadiazol-4-yl)octylhydrazine
SMILESCCCCCCCC(NN)c1csnn1
InChIInChI=1S/C10H20N4S/c1-2-3-4-5-6-7-9(12-11)10-8-15-14-13-10/h8-9,12H,2-7,11H2,1H3
InChIKeyQXHBMRCPPONIJP-UHFFFAOYSA-N
MW228.36 g/mol
LogP2.40
Rot. Bonds8

About 1-(thiadiazol-4-yl)octylhydrazine

1-(thiadiazol-4-yl)octylhydrazine (PubChem CID 105293500) has the molecular formula C10H20N4S and a molecular weight of 228.36 g/mol. Its IUPAC name is 1-(thiadiazol-4-yl)octylhydrazine.

Molecular Properties

Compound Name1-(thiadiazol-4-yl)octylhydrazine
PubChem CID105293500
Molecular FormulaC10H20N4S
Molecular Weight228.36 g/mol
Exact Mass228.14
IUPAC Name1-(thiadiazol-4-yl)octylhydrazine
SMILESCCCCCCCC(NN)c1csnn1
InChIInChI=1S/C10H20N4S/c1-2-3-4-5-6-7-9(12-11)10-8-15-14-13-10/h8-9,12H,2-7,11H2,1H3
InChIKeyQXHBMRCPPONIJP-UHFFFAOYSA-N
XLogP2.40
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.36
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 1-(thiadiazol-4-yl)octylhydrazine?
The IUPAC name of 1-(thiadiazol-4-yl)octylhydrazine (CID 105293500) is 1-(thiadiazol-4-yl)octylhydrazine.
What is the SMILES notation for 1-(thiadiazol-4-yl)octylhydrazine?
The canonical SMILES for 1-(thiadiazol-4-yl)octylhydrazine is CCCCCCCC(NN)c1csnn1.
What is the InChIKey of 1-(thiadiazol-4-yl)octylhydrazine?
The InChIKey is QXHBMRCPPONIJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4S/c1-2-3-4-5-6-7-9(12-11)10-8-15-14-13-10/h8-9,12H,2-7,11H2,1H3.
What are the key properties of 1-(thiadiazol-4-yl)octylhydrazine?
1-(thiadiazol-4-yl)octylhydrazine has a molecular weight of 228.36 g/mol, XLogP of 2.40, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(thiadiazol-4-yl)octylhydrazine is sourced from PubChem (CID 105293500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).