4-ethyl-N-methylthiadiazole-5-carboxamide

C6H9N3OS — CID 60718183

IUPAC4-ethyl-N-methylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)NC
InChIInChI=1S/C6H9N3OS/c1-3-4-5(6(10)7-2)11-9-8-4/h3H2,1-2H3,(H,7,10)
InChIKeyOPZNHYHRXTWLJO-UHFFFAOYSA-N
MW171.22 g/mol
LogP0.46
Rot. Bonds2

About 4-ethyl-N-methylthiadiazole-5-carboxamide

4-ethyl-N-methylthiadiazole-5-carboxamide (PubChem CID 60718183) has the molecular formula C6H9N3OS and a molecular weight of 171.22 g/mol. Its IUPAC name is 4-ethyl-N-methylthiadiazole-5-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-methylthiadiazole-5-carboxamide
PubChem CID60718183
Molecular FormulaC6H9N3OS
Molecular Weight171.22 g/mol
Exact Mass171.05
IUPAC Name4-ethyl-N-methylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)NC
InChIInChI=1S/C6H9N3OS/c1-3-4-5(6(10)7-2)11-9-8-4/h3H2,1-2H3,(H,7,10)
InChIKeyOPZNHYHRXTWLJO-UHFFFAOYSA-N
XLogP0.46
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.22
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-methylthiadiazole-5-carboxamide?
The IUPAC name of 4-ethyl-N-methylthiadiazole-5-carboxamide (CID 60718183) is 4-ethyl-N-methylthiadiazole-5-carboxamide.
What is the SMILES notation for 4-ethyl-N-methylthiadiazole-5-carboxamide?
The canonical SMILES for 4-ethyl-N-methylthiadiazole-5-carboxamide is CCc1nnsc1C(=O)NC.
What is the InChIKey of 4-ethyl-N-methylthiadiazole-5-carboxamide?
The InChIKey is OPZNHYHRXTWLJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3OS/c1-3-4-5(6(10)7-2)11-9-8-4/h3H2,1-2H3,(H,7,10).
What are the key properties of 4-ethyl-N-methylthiadiazole-5-carboxamide?
4-ethyl-N-methylthiadiazole-5-carboxamide has a molecular weight of 171.22 g/mol, XLogP of 0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-methylthiadiazole-5-carboxamide is sourced from PubChem (CID 60718183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).