1-methylsulfanylpropan-2-ylhydrazine

C4H12N2S — CID 55281387

IUPAC1-methylsulfanylpropan-2-ylhydrazine
SMILESCSCC(C)NN
InChIInChI=1S/C4H12N2S/c1-4(6-5)3-7-2/h4,6H,3,5H2,1-2H3
InChIKeyZKLZOKIAGQHBPA-UHFFFAOYSA-N
MW120.22 g/mol
LogP0.20
Rot. Bonds3

About 1-methylsulfanylpropan-2-ylhydrazine

1-methylsulfanylpropan-2-ylhydrazine (PubChem CID 55281387) has the molecular formula C4H12N2S and a molecular weight of 120.22 g/mol. Its IUPAC name is 1-methylsulfanylpropan-2-ylhydrazine.

Molecular Properties

Compound Name1-methylsulfanylpropan-2-ylhydrazine
PubChem CID55281387
Molecular FormulaC4H12N2S
Molecular Weight120.22 g/mol
Exact Mass120.07
IUPAC Name1-methylsulfanylpropan-2-ylhydrazine
SMILESCSCC(C)NN
InChIInChI=1S/C4H12N2S/c1-4(6-5)3-7-2/h4,6H,3,5H2,1-2H3
InChIKeyZKLZOKIAGQHBPA-UHFFFAOYSA-N
XLogP0.20
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.22
LogP ≤ 50.20
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-methylsulfanylpropan-2-ylhydrazine?
The IUPAC name of 1-methylsulfanylpropan-2-ylhydrazine (CID 55281387) is 1-methylsulfanylpropan-2-ylhydrazine.
What is the SMILES notation for 1-methylsulfanylpropan-2-ylhydrazine?
The canonical SMILES for 1-methylsulfanylpropan-2-ylhydrazine is CSCC(C)NN.
What is the InChIKey of 1-methylsulfanylpropan-2-ylhydrazine?
The InChIKey is ZKLZOKIAGQHBPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2S/c1-4(6-5)3-7-2/h4,6H,3,5H2,1-2H3.
What are the key properties of 1-methylsulfanylpropan-2-ylhydrazine?
1-methylsulfanylpropan-2-ylhydrazine has a molecular weight of 120.22 g/mol, XLogP of 0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylsulfanylpropan-2-ylhydrazine is sourced from PubChem (CID 55281387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).