methylsulfanylmethane;oxadiazole

C4H8N2OS — CID 66905708

IUPACmethylsulfanylmethane;oxadiazole
SMILESCSC.c1conn1
InChIInChI=1S/C2H2N2O.C2H6S/c1-2-5-4-3-1;1-3-2/h1-2H;1-2H3
InChIKeyMXVYLVKSDXGZGD-UHFFFAOYSA-N
MW132.19 g/mol
LogP1.05
Rot. Bonds

About methylsulfanylmethane;oxadiazole

methylsulfanylmethane;oxadiazole (PubChem CID 66905708) has the molecular formula C4H8N2OS and a molecular weight of 132.19 g/mol. Its IUPAC name is methylsulfanylmethane;oxadiazole.

Molecular Properties

Compound Namemethylsulfanylmethane;oxadiazole
PubChem CID66905708
Molecular FormulaC4H8N2OS
Molecular Weight132.19 g/mol
Exact Mass132.04
IUPAC Namemethylsulfanylmethane;oxadiazole
SMILESCSC.c1conn1
InChIInChI=1S/C2H2N2O.C2H6S/c1-2-5-4-3-1;1-3-2/h1-2H;1-2H3
InChIKeyMXVYLVKSDXGZGD-UHFFFAOYSA-N
XLogP1.05
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.19
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methylsulfanylmethane;oxadiazole?
The IUPAC name of methylsulfanylmethane;oxadiazole (CID 66905708) is methylsulfanylmethane;oxadiazole.
What is the SMILES notation for methylsulfanylmethane;oxadiazole?
The canonical SMILES for methylsulfanylmethane;oxadiazole is CSC.c1conn1.
What is the InChIKey of methylsulfanylmethane;oxadiazole?
The InChIKey is MXVYLVKSDXGZGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2N2O.C2H6S/c1-2-5-4-3-1;1-3-2/h1-2H;1-2H3.
What are the key properties of methylsulfanylmethane;oxadiazole?
methylsulfanylmethane;oxadiazole has a molecular weight of 132.19 g/mol, XLogP of 1.05, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methylsulfanylmethane;oxadiazole is sourced from PubChem (CID 66905708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).