(5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine

C7H14N4S — CID 69363932

IUPAC(5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine
SMILESCCCCCc1nnc(NN)s1
InChIInChI=1S/C7H14N4S/c1-2-3-4-5-6-10-11-7(9-8)12-6/h2-5,8H2,1H3,(H,9,11)
InChIKeyXGYPDGCYDOUSHY-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.56
Rot. Bonds5

About (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine

(5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine (PubChem CID 69363932) has the molecular formula C7H14N4S and a molecular weight of 186.28 g/mol. Its IUPAC name is (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine.

Molecular Properties

Compound Name(5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine
PubChem CID69363932
Molecular FormulaC7H14N4S
Molecular Weight186.28 g/mol
Exact Mass186.09
IUPAC Name(5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine
SMILESCCCCCc1nnc(NN)s1
InChIInChI=1S/C7H14N4S/c1-2-3-4-5-6-10-11-7(9-8)12-6/h2-5,8H2,1H3,(H,9,11)
InChIKeyXGYPDGCYDOUSHY-UHFFFAOYSA-N
XLogP1.56
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.56
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 (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine?
The IUPAC name of (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine (CID 69363932) is (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine.
What is the SMILES notation for (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine?
The canonical SMILES for (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine is CCCCCc1nnc(NN)s1.
What is the InChIKey of (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine?
The InChIKey is XGYPDGCYDOUSHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4S/c1-2-3-4-5-6-10-11-7(9-8)12-6/h2-5,8H2,1H3,(H,9,11).
What are the key properties of (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine?
(5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine has a molecular weight of 186.28 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-pentyl-1,3,4-thiadiazol-2-yl)hydrazine is sourced from PubChem (CID 69363932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).