5-bromothieno[2,3-b]pyridine

C7H4BrNS — CID 12885487

IUPAC5-bromothieno[2,3-b]pyridine
SMILESBrc1cnc2sccc2c1
InChIInChI=1S/C7H4BrNS/c8-6-3-5-1-2-10-7(5)9-4-6/h1-4H
InChIKeyYMOORGYWRBQPDZ-UHFFFAOYSA-N
MW214.09 g/mol
LogP3.06
Rot. Bonds

About 5-bromothieno[2,3-b]pyridine

5-bromothieno[2,3-b]pyridine (PubChem CID 12885487) has the molecular formula C7H4BrNS and a molecular weight of 214.09 g/mol. Its IUPAC name is 5-bromothieno[2,3-b]pyridine.

Molecular Properties

Compound Name5-bromothieno[2,3-b]pyridine
PubChem CID12885487
Molecular FormulaC7H4BrNS
Molecular Weight214.09 g/mol
Exact Mass212.92
IUPAC Name5-bromothieno[2,3-b]pyridine
SMILESBrc1cnc2sccc2c1
InChIInChI=1S/C7H4BrNS/c8-6-3-5-1-2-10-7(5)9-4-6/h1-4H
InChIKeyYMOORGYWRBQPDZ-UHFFFAOYSA-N
XLogP3.06
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.09
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-bromothieno[2,3-b]pyridine?
The IUPAC name of 5-bromothieno[2,3-b]pyridine (CID 12885487) is 5-bromothieno[2,3-b]pyridine.
What is the SMILES notation for 5-bromothieno[2,3-b]pyridine?
The canonical SMILES for 5-bromothieno[2,3-b]pyridine is Brc1cnc2sccc2c1.
What is the InChIKey of 5-bromothieno[2,3-b]pyridine?
The InChIKey is YMOORGYWRBQPDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrNS/c8-6-3-5-1-2-10-7(5)9-4-6/h1-4H.
What are the key properties of 5-bromothieno[2,3-b]pyridine?
5-bromothieno[2,3-b]pyridine has a molecular weight of 214.09 g/mol, XLogP of 3.06, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromothieno[2,3-b]pyridine is sourced from PubChem (CID 12885487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).