5-imidazolidin-2-ylthiadiazole

C5H8N4S — CID 173407016

IUPAC5-imidazolidin-2-ylthiadiazole
SMILESc1nnsc1C1NCCN1
InChIInChI=1S/C5H8N4S/c1-2-7-5(6-1)4-3-8-9-10-4/h3,5-7H,1-2H2
InChIKeyRMKHVUUXXADHFB-UHFFFAOYSA-N
MW156.21 g/mol
LogP-0.27
Rot. Bonds1

About 5-imidazolidin-2-ylthiadiazole

5-imidazolidin-2-ylthiadiazole (PubChem CID 173407016) has the molecular formula C5H8N4S and a molecular weight of 156.21 g/mol. Its IUPAC name is 5-imidazolidin-2-ylthiadiazole.

Molecular Properties

Compound Name5-imidazolidin-2-ylthiadiazole
PubChem CID173407016
Molecular FormulaC5H8N4S
Molecular Weight156.21 g/mol
Exact Mass156.05
IUPAC Name5-imidazolidin-2-ylthiadiazole
SMILESc1nnsc1C1NCCN1
InChIInChI=1S/C5H8N4S/c1-2-7-5(6-1)4-3-8-9-10-4/h3,5-7H,1-2H2
InChIKeyRMKHVUUXXADHFB-UHFFFAOYSA-N
XLogP-0.27
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.21
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-imidazolidin-2-ylthiadiazole?
The IUPAC name of 5-imidazolidin-2-ylthiadiazole (CID 173407016) is 5-imidazolidin-2-ylthiadiazole.
What is the SMILES notation for 5-imidazolidin-2-ylthiadiazole?
The canonical SMILES for 5-imidazolidin-2-ylthiadiazole is c1nnsc1C1NCCN1.
What is the InChIKey of 5-imidazolidin-2-ylthiadiazole?
The InChIKey is RMKHVUUXXADHFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4S/c1-2-7-5(6-1)4-3-8-9-10-4/h3,5-7H,1-2H2.
What are the key properties of 5-imidazolidin-2-ylthiadiazole?
5-imidazolidin-2-ylthiadiazole has a molecular weight of 156.21 g/mol, XLogP of -0.27, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-imidazolidin-2-ylthiadiazole is sourced from PubChem (CID 173407016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).