2-(1,3,4-thiadiazol-2-yloxy)acetamide

C4H5N3O2S — CID 18602116

IUPAC2-(1,3,4-thiadiazol-2-yloxy)acetamide
SMILESNC(=O)COc1nncs1
InChIInChI=1S/C4H5N3O2S/c5-3(8)1-9-4-7-6-2-10-4/h2H,1H2,(H2,5,8)
InChIKeyTUMFHRSSMDZROA-UHFFFAOYSA-N
MW159.17 g/mol
LogP-0.60
Rot. Bonds3

About 2-(1,3,4-thiadiazol-2-yloxy)acetamide

2-(1,3,4-thiadiazol-2-yloxy)acetamide (PubChem CID 18602116) has the molecular formula C4H5N3O2S and a molecular weight of 159.17 g/mol. Its IUPAC name is 2-(1,3,4-thiadiazol-2-yloxy)acetamide.

Molecular Properties

Compound Name2-(1,3,4-thiadiazol-2-yloxy)acetamide
PubChem CID18602116
Molecular FormulaC4H5N3O2S
Molecular Weight159.17 g/mol
Exact Mass159.01
IUPAC Name2-(1,3,4-thiadiazol-2-yloxy)acetamide
SMILESNC(=O)COc1nncs1
InChIInChI=1S/C4H5N3O2S/c5-3(8)1-9-4-7-6-2-10-4/h2H,1H2,(H2,5,8)
InChIKeyTUMFHRSSMDZROA-UHFFFAOYSA-N
XLogP-0.60
TPSA78.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.17
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3,4-thiadiazol-2-yloxy)acetamide?
The IUPAC name of 2-(1,3,4-thiadiazol-2-yloxy)acetamide (CID 18602116) is 2-(1,3,4-thiadiazol-2-yloxy)acetamide.
What is the SMILES notation for 2-(1,3,4-thiadiazol-2-yloxy)acetamide?
The canonical SMILES for 2-(1,3,4-thiadiazol-2-yloxy)acetamide is NC(=O)COc1nncs1.
What is the InChIKey of 2-(1,3,4-thiadiazol-2-yloxy)acetamide?
The InChIKey is TUMFHRSSMDZROA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N3O2S/c5-3(8)1-9-4-7-6-2-10-4/h2H,1H2,(H2,5,8).
What are the key properties of 2-(1,3,4-thiadiazol-2-yloxy)acetamide?
2-(1,3,4-thiadiazol-2-yloxy)acetamide has a molecular weight of 159.17 g/mol, XLogP of -0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3,4-thiadiazol-2-yloxy)acetamide is sourced from PubChem (CID 18602116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).