4-(methoxymethyl)thiadiazole

C4H6N2OS — CID 23080864

IUPAC4-(methoxymethyl)thiadiazole
SMILESCOCc1csnn1
InChIInChI=1S/C4H6N2OS/c1-7-2-4-3-8-6-5-4/h3H,2H2,1H3
InChIKeyVOEGOMSUWZOVGK-UHFFFAOYSA-N
MW130.17 g/mol
LogP0.68
Rot. Bonds2

About 4-(methoxymethyl)thiadiazole

4-(methoxymethyl)thiadiazole (PubChem CID 23080864) has the molecular formula C4H6N2OS and a molecular weight of 130.17 g/mol. Its IUPAC name is 4-(methoxymethyl)thiadiazole.

Molecular Properties

Compound Name4-(methoxymethyl)thiadiazole
PubChem CID23080864
Molecular FormulaC4H6N2OS
Molecular Weight130.17 g/mol
Exact Mass130.02
IUPAC Name4-(methoxymethyl)thiadiazole
SMILESCOCc1csnn1
InChIInChI=1S/C4H6N2OS/c1-7-2-4-3-8-6-5-4/h3H,2H2,1H3
InChIKeyVOEGOMSUWZOVGK-UHFFFAOYSA-N
XLogP0.68
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.17
LogP ≤ 50.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)thiadiazole?
The IUPAC name of 4-(methoxymethyl)thiadiazole (CID 23080864) is 4-(methoxymethyl)thiadiazole.
What is the SMILES notation for 4-(methoxymethyl)thiadiazole?
The canonical SMILES for 4-(methoxymethyl)thiadiazole is COCc1csnn1.
What is the InChIKey of 4-(methoxymethyl)thiadiazole?
The InChIKey is VOEGOMSUWZOVGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2OS/c1-7-2-4-3-8-6-5-4/h3H,2H2,1H3.
What are the key properties of 4-(methoxymethyl)thiadiazole?
4-(methoxymethyl)thiadiazole has a molecular weight of 130.17 g/mol, XLogP of 0.68, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)thiadiazole is sourced from PubChem (CID 23080864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).