1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine

C5H12N2O2S — CID 13072371

IUPAC1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine
SMILESCN(N)C1CCS(=O)(=O)C1
InChIInChI=1S/C5H12N2O2S/c1-7(6)5-2-3-10(8,9)4-5/h5H,2-4,6H2,1H3
InChIKeyZCFJRYAYWQEWTO-UHFFFAOYSA-N
MW164.23 g/mol
LogP-1.02
Rot. Bonds1

About 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine

1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine (PubChem CID 13072371) has the molecular formula C5H12N2O2S and a molecular weight of 164.23 g/mol. Its IUPAC name is 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine.

Molecular Properties

Compound Name1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine
PubChem CID13072371
Molecular FormulaC5H12N2O2S
Molecular Weight164.23 g/mol
Exact Mass164.06
IUPAC Name1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine
SMILESCN(N)C1CCS(=O)(=O)C1
InChIInChI=1S/C5H12N2O2S/c1-7(6)5-2-3-10(8,9)4-5/h5H,2-4,6H2,1H3
InChIKeyZCFJRYAYWQEWTO-UHFFFAOYSA-N
XLogP-1.02
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.23
LogP ≤ 5-1.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

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2-(1,1-Dioxidotetrahydrothiophen-3-yl)-1,1-dimethylhydrazine
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2-(1,1-Dioxothiolan-3-yl)-1,1-dimethylhydrazine chloride
CID 53346909
4-Amino-3,5-dimethyl-1lambda~6~,4-thiazinane-1,1-dione
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1-(1,1-Dioxothiolan-3-yl)-1-methylhydrazine;hydrochloride
CID 20260337
3-(Methylsulfonyl)pyrrolidin-1-amine
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1-Methyl-1-(1-oxothiolan-3-yl)hydrazine
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Frequently Asked Questions

What is the IUPAC name of 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine?
The IUPAC name of 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine (CID 13072371) is 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine.
What is the SMILES notation for 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine?
The canonical SMILES for 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine is CN(N)C1CCS(=O)(=O)C1.
What is the InChIKey of 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine?
The InChIKey is ZCFJRYAYWQEWTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2S/c1-7(6)5-2-3-10(8,9)4-5/h5H,2-4,6H2,1H3.
What are the key properties of 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine?
1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine has a molecular weight of 164.23 g/mol, XLogP of -1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,1-dioxothiolan-3-yl)-1-methylhydrazine is sourced from PubChem (CID 13072371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).