4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide

C10H10N4OS — CID 25345538

IUPAC4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)Nc1cccnc1
InChIInChI=1S/C10H10N4OS/c1-2-8-9(16-14-13-8)10(15)12-7-4-3-5-11-6-7/h3-6H,2H2,1H3,(H,12,15)
InChIKeyAUUASBMKTUFDLO-UHFFFAOYSA-N
MW234.28 g/mol
LogP1.75
Rot. Bonds3

About 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide

4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide (PubChem CID 25345538) has the molecular formula C10H10N4OS and a molecular weight of 234.28 g/mol. Its IUPAC name is 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide.

Molecular Properties

Compound Name4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide
PubChem CID25345538
Molecular FormulaC10H10N4OS
Molecular Weight234.28 g/mol
Exact Mass234.06
IUPAC Name4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide
SMILESCCc1nnsc1C(=O)Nc1cccnc1
InChIInChI=1S/C10H10N4OS/c1-2-8-9(16-14-13-8)10(15)12-7-4-3-5-11-6-7/h3-6H,2H2,1H3,(H,12,15)
InChIKeyAUUASBMKTUFDLO-UHFFFAOYSA-N
XLogP1.75
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.28
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide?
The IUPAC name of 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide (CID 25345538) is 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide.
What is the SMILES notation for 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide?
The canonical SMILES for 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide is CCc1nnsc1C(=O)Nc1cccnc1.
What is the InChIKey of 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide?
The InChIKey is AUUASBMKTUFDLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4OS/c1-2-8-9(16-14-13-8)10(15)12-7-4-3-5-11-6-7/h3-6H,2H2,1H3,(H,12,15).
What are the key properties of 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide?
4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide has a molecular weight of 234.28 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-pyridin-3-ylthiadiazole-5-carboxamide is sourced from PubChem (CID 25345538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).