2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide

C8H13N5OS — CID 114912326

IUPAC2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide
SMILESO=C(CN1CCNCC1)Nc1cnns1
InChIInChI=1S/C8H13N5OS/c14-7(11-8-5-10-12-15-8)6-13-3-1-9-2-4-13/h5,9H,1-4,6H2,(H,11,14)
InChIKeyVWFLCUZBNSPYNG-UHFFFAOYSA-N
MW227.29 g/mol
LogP-0.62
Rot. Bonds3

About 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide

2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide (PubChem CID 114912326) has the molecular formula C8H13N5OS and a molecular weight of 227.29 g/mol. Its IUPAC name is 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide.

Molecular Properties

Compound Name2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide
PubChem CID114912326
Molecular FormulaC8H13N5OS
Molecular Weight227.29 g/mol
Exact Mass227.08
IUPAC Name2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide
SMILESO=C(CN1CCNCC1)Nc1cnns1
InChIInChI=1S/C8H13N5OS/c14-7(11-8-5-10-12-15-8)6-13-3-1-9-2-4-13/h5,9H,1-4,6H2,(H,11,14)
InChIKeyVWFLCUZBNSPYNG-UHFFFAOYSA-N
XLogP-0.62
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.29
LogP ≤ 5-0.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide?
The IUPAC name of 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide (CID 114912326) is 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide.
What is the SMILES notation for 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide?
The canonical SMILES for 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide is O=C(CN1CCNCC1)Nc1cnns1.
What is the InChIKey of 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide?
The InChIKey is VWFLCUZBNSPYNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5OS/c14-7(11-8-5-10-12-15-8)6-13-3-1-9-2-4-13/h5,9H,1-4,6H2,(H,11,14).
What are the key properties of 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide?
2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide has a molecular weight of 227.29 g/mol, XLogP of -0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-N-(thiadiazol-5-yl)acetamide is sourced from PubChem (CID 114912326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).