2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide

C8H11N7OS2 — CID 23941553

IUPAC2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCCn1nnnc1SCC(=O)Nc1nnc(C)s1
InChIInChI=1S/C8H11N7OS2/c1-3-15-8(12-13-14-15)17-4-6(16)9-7-11-10-5(2)18-7/h3-4H2,1-2H3,(H,9,11,16)
InChIKeyGCZREIQWQJELKD-UHFFFAOYSA-N
MW285.36 g/mol
LogP0.58
Rot. Bonds5

About 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide

2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 23941553) has the molecular formula C8H11N7OS2 and a molecular weight of 285.36 g/mol. Its IUPAC name is 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
PubChem CID23941553
Molecular FormulaC8H11N7OS2
Molecular Weight285.36 g/mol
Exact Mass285.05
IUPAC Name2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
SMILESCCn1nnnc1SCC(=O)Nc1nnc(C)s1
InChIInChI=1S/C8H11N7OS2/c1-3-15-8(12-13-14-15)17-4-6(16)9-7-11-10-5(2)18-7/h3-4H2,1-2H3,(H,9,11,16)
InChIKeyGCZREIQWQJELKD-UHFFFAOYSA-N
XLogP0.58
TPSA98.48 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide (CID 23941553) is 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide is CCn1nnnc1SCC(=O)Nc1nnc(C)s1.
What is the InChIKey of 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is GCZREIQWQJELKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N7OS2/c1-3-15-8(12-13-14-15)17-4-6(16)9-7-11-10-5(2)18-7/h3-4H2,1-2H3,(H,9,11,16).
What are the key properties of 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide?
2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 285.36 g/mol, XLogP of 0.58, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethyltetrazol-5-yl)sulfanyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 23941553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).