4-methylsulfanylpyrazolidine

C4H10N2S — CID 134173917

IUPAC4-methylsulfanylpyrazolidine
SMILESCSC1CNNC1
InChIInChI=1S/C4H10N2S/c1-7-4-2-5-6-3-4/h4-6H,2-3H2,1H3
InChIKeyFGMTUENUTBKIIS-UHFFFAOYSA-N
MW118.20 g/mol
LogP-0.17
Rot. Bonds1

About 4-methylsulfanylpyrazolidine

4-methylsulfanylpyrazolidine (PubChem CID 134173917) has the molecular formula C4H10N2S and a molecular weight of 118.20 g/mol. Its IUPAC name is 4-methylsulfanylpyrazolidine.

Molecular Properties

Compound Name4-methylsulfanylpyrazolidine
PubChem CID134173917
Molecular FormulaC4H10N2S
Molecular Weight118.20 g/mol
Exact Mass118.06
IUPAC Name4-methylsulfanylpyrazolidine
SMILESCSC1CNNC1
InChIInChI=1S/C4H10N2S/c1-7-4-2-5-6-3-4/h4-6H,2-3H2,1H3
InChIKeyFGMTUENUTBKIIS-UHFFFAOYSA-N
XLogP-0.17
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.20
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methylsulfanylpyrazolidine?
The IUPAC name of 4-methylsulfanylpyrazolidine (CID 134173917) is 4-methylsulfanylpyrazolidine.
What is the SMILES notation for 4-methylsulfanylpyrazolidine?
The canonical SMILES for 4-methylsulfanylpyrazolidine is CSC1CNNC1.
What is the InChIKey of 4-methylsulfanylpyrazolidine?
The InChIKey is FGMTUENUTBKIIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2S/c1-7-4-2-5-6-3-4/h4-6H,2-3H2,1H3.
What are the key properties of 4-methylsulfanylpyrazolidine?
4-methylsulfanylpyrazolidine has a molecular weight of 118.20 g/mol, XLogP of -0.17, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylsulfanylpyrazolidine is sourced from PubChem (CID 134173917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).