7-ethylthiadiazolo[5,4-b]pyridine

C7H7N3S — CID 91089066

IUPAC7-ethylthiadiazolo[5,4-b]pyridine
SMILESCCc1ccnc2snnc12
InChIInChI=1S/C7H7N3S/c1-2-5-3-4-8-7-6(5)9-10-11-7/h3-4H,2H2,1H3
InChIKeyLEJSDQSAZIPAMM-UHFFFAOYSA-N
MW165.22 g/mol
LogP1.65
Rot. Bonds1

About 7-ethylthiadiazolo[5,4-b]pyridine

7-ethylthiadiazolo[5,4-b]pyridine (PubChem CID 91089066) has the molecular formula C7H7N3S and a molecular weight of 165.22 g/mol. Its IUPAC name is 7-ethylthiadiazolo[5,4-b]pyridine.

Molecular Properties

Compound Name7-ethylthiadiazolo[5,4-b]pyridine
PubChem CID91089066
Molecular FormulaC7H7N3S
Molecular Weight165.22 g/mol
Exact Mass165.04
IUPAC Name7-ethylthiadiazolo[5,4-b]pyridine
SMILESCCc1ccnc2snnc12
InChIInChI=1S/C7H7N3S/c1-2-5-3-4-8-7-6(5)9-10-11-7/h3-4H,2H2,1H3
InChIKeyLEJSDQSAZIPAMM-UHFFFAOYSA-N
XLogP1.65
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.22
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-ethylthiadiazolo[5,4-b]pyridine?
The IUPAC name of 7-ethylthiadiazolo[5,4-b]pyridine (CID 91089066) is 7-ethylthiadiazolo[5,4-b]pyridine.
What is the SMILES notation for 7-ethylthiadiazolo[5,4-b]pyridine?
The canonical SMILES for 7-ethylthiadiazolo[5,4-b]pyridine is CCc1ccnc2snnc12.
What is the InChIKey of 7-ethylthiadiazolo[5,4-b]pyridine?
The InChIKey is LEJSDQSAZIPAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3S/c1-2-5-3-4-8-7-6(5)9-10-11-7/h3-4H,2H2,1H3.
What are the key properties of 7-ethylthiadiazolo[5,4-b]pyridine?
7-ethylthiadiazolo[5,4-b]pyridine has a molecular weight of 165.22 g/mol, XLogP of 1.65, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethylthiadiazolo[5,4-b]pyridine is sourced from PubChem (CID 91089066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).