N-(thiadiazol-4-yl)acetamide

C4H5N3OS — CID 20977757

IUPACN-(thiadiazol-4-yl)acetamide
SMILESCC(=O)Nc1csnn1
InChIInChI=1S/C4H5N3OS/c1-3(8)5-4-2-9-7-6-4/h2H,1H3,(H,5,8)
InChIKeyJBQFWBGRKPEKJZ-UHFFFAOYSA-N
MW143.17 g/mol
LogP0.50
Rot. Bonds1

About N-(thiadiazol-4-yl)acetamide

N-(thiadiazol-4-yl)acetamide (PubChem CID 20977757) has the molecular formula C4H5N3OS and a molecular weight of 143.17 g/mol. Its IUPAC name is N-(thiadiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(thiadiazol-4-yl)acetamide
PubChem CID20977757
Molecular FormulaC4H5N3OS
Molecular Weight143.17 g/mol
Exact Mass143.02
IUPAC NameN-(thiadiazol-4-yl)acetamide
SMILESCC(=O)Nc1csnn1
InChIInChI=1S/C4H5N3OS/c1-3(8)5-4-2-9-7-6-4/h2H,1H3,(H,5,8)
InChIKeyJBQFWBGRKPEKJZ-UHFFFAOYSA-N
XLogP0.50
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.17
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(thiadiazol-4-yl)acetamide?
The IUPAC name of N-(thiadiazol-4-yl)acetamide (CID 20977757) is N-(thiadiazol-4-yl)acetamide.
What is the SMILES notation for N-(thiadiazol-4-yl)acetamide?
The canonical SMILES for N-(thiadiazol-4-yl)acetamide is CC(=O)Nc1csnn1.
What is the InChIKey of N-(thiadiazol-4-yl)acetamide?
The InChIKey is JBQFWBGRKPEKJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N3OS/c1-3(8)5-4-2-9-7-6-4/h2H,1H3,(H,5,8).
What are the key properties of N-(thiadiazol-4-yl)acetamide?
N-(thiadiazol-4-yl)acetamide has a molecular weight of 143.17 g/mol, XLogP of 0.50, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiadiazol-4-yl)acetamide is sourced from PubChem (CID 20977757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).