thiohydroxylamine;triazane

H8N4S — CID 161303654

IUPACthiohydroxylamine;triazane
SMILESNNN.NS
InChIInChI=1S/H5N3.H3NS/c1-3-2;1-2/h3H,1-2H2;2H,1H2
InChIKeyVHYJKZWJORACHP-UHFFFAOYSA-N
MW96.16 g/mol
LogP-1.89
Rot. Bonds

About thiohydroxylamine;triazane

thiohydroxylamine;triazane (PubChem CID 161303654) has the molecular formula H8N4S and a molecular weight of 96.16 g/mol. Its IUPAC name is thiohydroxylamine;triazane.

Molecular Properties

Compound Namethiohydroxylamine;triazane
PubChem CID161303654
Molecular FormulaH8N4S
Molecular Weight96.16 g/mol
Exact Mass96.05
IUPAC Namethiohydroxylamine;triazane
SMILESNNN.NS
InChIInChI=1S/H5N3.H3NS/c1-3-2;1-2/h3H,1-2H2;2H,1H2
InChIKeyVHYJKZWJORACHP-UHFFFAOYSA-N
XLogP-1.89
TPSA90.09 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.16
LogP ≤ 5-1.89
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

triazane;hydrate
CID 162025964
methanimine;triazane
CID 144519373
dihydrazinylphosphinothious acid
CID 57357548
cyclohexane;thiohydroxylamine
CID 142523314
phosphanylhydrazine
CID 20681621
fluorohydrazine
CID 21071432
N-aminoselenohydroxylamine
CID 173012389
CID 175904545
CID 175904545
CID 158045573
CID 158045573
azane;methylhydrazine
CID 174498932
methanamine;methylhydrazine
CID 159535061
carbamothioic S-acid;hydrazinecarboxylic acid
CID 174980656

Frequently Asked Questions

What is the IUPAC name of thiohydroxylamine;triazane?
The IUPAC name of thiohydroxylamine;triazane (CID 161303654) is thiohydroxylamine;triazane.
What is the SMILES notation for thiohydroxylamine;triazane?
The canonical SMILES for thiohydroxylamine;triazane is NNN.NS.
What is the InChIKey of thiohydroxylamine;triazane?
The InChIKey is VHYJKZWJORACHP-UHFFFAOYSA-N. The full InChI is InChI=1S/H5N3.H3NS/c1-3-2;1-2/h3H,1-2H2;2H,1H2.
What are the key properties of thiohydroxylamine;triazane?
thiohydroxylamine;triazane has a molecular weight of 96.16 g/mol, XLogP of -1.89, 0 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for thiohydroxylamine;triazane is sourced from PubChem (CID 161303654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).