1-hydrazinylidene-1-oxothiolan-3-ol

C4H10N2O2S — CID 129116463

IUPAC1-hydrazinylidene-1-oxothiolan-3-ol
SMILESNN=S1(=O)CCC(O)C1
InChIInChI=1S/C4H10N2O2S/c5-6-9(8)2-1-4(7)3-9/h4,7H,1-3,5H2
InChIKeySOVXCIUABQCVSX-UHFFFAOYSA-N
MW150.20 g/mol
LogP-0.91
Rot. Bonds

About 1-hydrazinylidene-1-oxothiolan-3-ol

1-hydrazinylidene-1-oxothiolan-3-ol (PubChem CID 129116463) has the molecular formula C4H10N2O2S and a molecular weight of 150.20 g/mol. Its IUPAC name is 1-hydrazinylidene-1-oxothiolan-3-ol.

Molecular Properties

Compound Name1-hydrazinylidene-1-oxothiolan-3-ol
PubChem CID129116463
Molecular FormulaC4H10N2O2S
Molecular Weight150.20 g/mol
Exact Mass150.05
IUPAC Name1-hydrazinylidene-1-oxothiolan-3-ol
SMILESNN=S1(=O)CCC(O)C1
InChIInChI=1S/C4H10N2O2S/c5-6-9(8)2-1-4(7)3-9/h4,7H,1-3,5H2
InChIKeySOVXCIUABQCVSX-UHFFFAOYSA-N
XLogP-0.91
TPSA75.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.20
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-hydrazinylidene-1-oxothiolan-3-ol?
The IUPAC name of 1-hydrazinylidene-1-oxothiolan-3-ol (CID 129116463) is 1-hydrazinylidene-1-oxothiolan-3-ol.
What is the SMILES notation for 1-hydrazinylidene-1-oxothiolan-3-ol?
The canonical SMILES for 1-hydrazinylidene-1-oxothiolan-3-ol is NN=S1(=O)CCC(O)C1.
What is the InChIKey of 1-hydrazinylidene-1-oxothiolan-3-ol?
The InChIKey is SOVXCIUABQCVSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2S/c5-6-9(8)2-1-4(7)3-9/h4,7H,1-3,5H2.
What are the key properties of 1-hydrazinylidene-1-oxothiolan-3-ol?
1-hydrazinylidene-1-oxothiolan-3-ol has a molecular weight of 150.20 g/mol, XLogP of -0.91, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydrazinylidene-1-oxothiolan-3-ol is sourced from PubChem (CID 129116463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).