ethylhydrazine;methanethioamide

C3H11N3S — CID 160547299

IUPACethylhydrazine;methanethioamide
SMILESCCNN.NC=S
InChIInChI=1S/C2H8N2.CH3NS/c1-2-4-3;2-1-3/h4H,2-3H2,1H3;1H,(H2,2,3)
InChIKeyQXPFUPMJUHRIEW-UHFFFAOYSA-N
MW121.21 g/mol
LogP-0.63
Rot. Bonds1

About ethylhydrazine;methanethioamide

ethylhydrazine;methanethioamide (PubChem CID 160547299) has the molecular formula C3H11N3S and a molecular weight of 121.21 g/mol. Its IUPAC name is ethylhydrazine;methanethioamide.

Molecular Properties

Compound Nameethylhydrazine;methanethioamide
PubChem CID160547299
Molecular FormulaC3H11N3S
Molecular Weight121.21 g/mol
Exact Mass121.07
IUPAC Nameethylhydrazine;methanethioamide
SMILESCCNN.NC=S
InChIInChI=1S/C2H8N2.CH3NS/c1-2-4-3;2-1-3/h4H,2-3H2,1H3;1H,(H2,2,3)
InChIKeyQXPFUPMJUHRIEW-UHFFFAOYSA-N
XLogP-0.63
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.21
LogP ≤ 5-0.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethylhydrazine;methanethioamide?
The IUPAC name of ethylhydrazine;methanethioamide (CID 160547299) is ethylhydrazine;methanethioamide.
What is the SMILES notation for ethylhydrazine;methanethioamide?
The canonical SMILES for ethylhydrazine;methanethioamide is CCNN.NC=S.
What is the InChIKey of ethylhydrazine;methanethioamide?
The InChIKey is QXPFUPMJUHRIEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8N2.CH3NS/c1-2-4-3;2-1-3/h4H,2-3H2,1H3;1H,(H2,2,3).
What are the key properties of ethylhydrazine;methanethioamide?
ethylhydrazine;methanethioamide has a molecular weight of 121.21 g/mol, XLogP of -0.63, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethylhydrazine;methanethioamide is sourced from PubChem (CID 160547299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).