6,7-dihydrothieno[3,2-b]pyridine

C7H7NS — CID 68921578

IUPAC6,7-dihydrothieno[3,2-b]pyridine
SMILESC1=Nc2ccsc2CC1
InChIInChI=1S/C7H7NS/c1-2-7-6(8-4-1)3-5-9-7/h3-5H,1-2H2
InChIKeyCFBNXTGJJPBTBK-UHFFFAOYSA-N
MW137.21 g/mol
LogP2.40
Rot. Bonds

About 6,7-dihydrothieno[3,2-b]pyridine

6,7-dihydrothieno[3,2-b]pyridine (PubChem CID 68921578) has the molecular formula C7H7NS and a molecular weight of 137.21 g/mol. Its IUPAC name is 6,7-dihydrothieno[3,2-b]pyridine.

Molecular Properties

Compound Name6,7-dihydrothieno[3,2-b]pyridine
PubChem CID68921578
Molecular FormulaC7H7NS
Molecular Weight137.21 g/mol
Exact Mass137.03
IUPAC Name6,7-dihydrothieno[3,2-b]pyridine
SMILESC1=Nc2ccsc2CC1
InChIInChI=1S/C7H7NS/c1-2-7-6(8-4-1)3-5-9-7/h3-5H,1-2H2
InChIKeyCFBNXTGJJPBTBK-UHFFFAOYSA-N
XLogP2.40
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.21
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,7-dihydrothieno[3,2-b]pyridine?
The IUPAC name of 6,7-dihydrothieno[3,2-b]pyridine (CID 68921578) is 6,7-dihydrothieno[3,2-b]pyridine.
What is the SMILES notation for 6,7-dihydrothieno[3,2-b]pyridine?
The canonical SMILES for 6,7-dihydrothieno[3,2-b]pyridine is C1=Nc2ccsc2CC1.
What is the InChIKey of 6,7-dihydrothieno[3,2-b]pyridine?
The InChIKey is CFBNXTGJJPBTBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NS/c1-2-7-6(8-4-1)3-5-9-7/h3-5H,1-2H2.
What are the key properties of 6,7-dihydrothieno[3,2-b]pyridine?
6,7-dihydrothieno[3,2-b]pyridine has a molecular weight of 137.21 g/mol, XLogP of 2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydrothieno[3,2-b]pyridine is sourced from PubChem (CID 68921578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).