5-bromo-2-ethylthieno[2,3-b]pyridine

C9H8BrNS — CID 91250034

IUPAC5-bromo-2-ethylthieno[2,3-b]pyridine
SMILESCCc1cc2cc(Br)cnc2s1
InChIInChI=1S/C9H8BrNS/c1-2-8-4-6-3-7(10)5-11-9(6)12-8/h3-5H,2H2,1H3
InChIKeyASPCGKFFXUHAOK-UHFFFAOYSA-N
MW242.14 g/mol
LogP3.62
Rot. Bonds1

About 5-bromo-2-ethylthieno[2,3-b]pyridine

5-bromo-2-ethylthieno[2,3-b]pyridine (PubChem CID 91250034) has the molecular formula C9H8BrNS and a molecular weight of 242.14 g/mol. Its IUPAC name is 5-bromo-2-ethylthieno[2,3-b]pyridine.

Molecular Properties

Compound Name5-bromo-2-ethylthieno[2,3-b]pyridine
PubChem CID91250034
Molecular FormulaC9H8BrNS
Molecular Weight242.14 g/mol
Exact Mass240.96
IUPAC Name5-bromo-2-ethylthieno[2,3-b]pyridine
SMILESCCc1cc2cc(Br)cnc2s1
InChIInChI=1S/C9H8BrNS/c1-2-8-4-6-3-7(10)5-11-9(6)12-8/h3-5H,2H2,1H3
InChIKeyASPCGKFFXUHAOK-UHFFFAOYSA-N
XLogP3.62
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.14
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclopropyl-2-ethylthieno[2,3-b]pyridine
CID 171090119
6-bromo-2-ethylsulfanyl-[1,3]thiazolo[5,4-b]pyridine
CID 117097307
5-bromo-N-(3-tert-butyl-1-methylpyrazol-5-yl)thieno[2,3-b]pyridine-2-carboxamide
CID 155287799
6-ethyl-3H-thieno[2,3-d]pyrimidine-4-thione
CID 745975
2-ethylthieno[3,2-c]pyridine
CID 70413721
7-bromo-3-ethylpyrido[2,3-b]pyrazine
CID 175916445
5-bromo-2-(bromomethyl)-7-ethyl-1-benzothiophene
CID 131214219
5-bromo-2-chloro-N-[(5-ethylthiophen-2-yl)methyl]pyridine-3-carboxamide
CID 99355657
5-bromo-2-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)pyridine-2,3-diamine
CID 114052101
N-[(4-bromothiophen-2-yl)methyl]-5-ethyl-1,3-thiazol-2-amine
CID 104599797
4-(4-bromo-2-methylphenoxy)-6-ethylthieno[2,3-d]pyrimidin-2-amine
CID 103332531
6-bromo-2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride
CID 67462755

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-ethylthieno[2,3-b]pyridine?
The IUPAC name of 5-bromo-2-ethylthieno[2,3-b]pyridine (CID 91250034) is 5-bromo-2-ethylthieno[2,3-b]pyridine.
What is the SMILES notation for 5-bromo-2-ethylthieno[2,3-b]pyridine?
The canonical SMILES for 5-bromo-2-ethylthieno[2,3-b]pyridine is CCc1cc2cc(Br)cnc2s1.
What is the InChIKey of 5-bromo-2-ethylthieno[2,3-b]pyridine?
The InChIKey is ASPCGKFFXUHAOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrNS/c1-2-8-4-6-3-7(10)5-11-9(6)12-8/h3-5H,2H2,1H3.
What are the key properties of 5-bromo-2-ethylthieno[2,3-b]pyridine?
5-bromo-2-ethylthieno[2,3-b]pyridine has a molecular weight of 242.14 g/mol, XLogP of 3.62, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-ethylthieno[2,3-b]pyridine is sourced from PubChem (CID 91250034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).