5,7a-dihydrothieno[3,2-c]pyridine

C7H7NS — CID 91319826

IUPAC5,7a-dihydrothieno[3,2-c]pyridine
SMILESC1=CC2SC=CC2=CN1
InChIInChI=1S/C7H7NS/c1-3-8-5-6-2-4-9-7(1)6/h1-5,7-8H
InChIKeyCHNUGUJVGVXIGM-UHFFFAOYSA-N
MW137.21 g/mol
LogP1.62
Rot. Bonds

About 5,7a-dihydrothieno[3,2-c]pyridine

5,7a-dihydrothieno[3,2-c]pyridine (PubChem CID 91319826) has the molecular formula C7H7NS and a molecular weight of 137.21 g/mol. Its IUPAC name is 5,7a-dihydrothieno[3,2-c]pyridine.

Molecular Properties

Compound Name5,7a-dihydrothieno[3,2-c]pyridine
PubChem CID91319826
Molecular FormulaC7H7NS
Molecular Weight137.21 g/mol
Exact Mass137.03
IUPAC Name5,7a-dihydrothieno[3,2-c]pyridine
SMILESC1=CC2SC=CC2=CN1
InChIInChI=1S/C7H7NS/c1-3-8-5-6-2-4-9-7(1)6/h1-5,7-8H
InChIKeyCHNUGUJVGVXIGM-UHFFFAOYSA-N
XLogP1.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.21
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,3a,4,5-Tetrahydrothieno[3,4-c]pyridine
CID 21659744
6H-thiopyrano[4,3-c]pyridine
CID 21666649
7,7a-Dihydrothieno[2,3-b]pyridine
CID 22507173
7,7a-Dihydrothiopyrano[2,3-b]pyrrole
CID 22556929
5,6-Dihydrothieno[2,3-c]pyridine
CID 69324466
5H-thieno[3,2-c]pyridine 1-oxide
CID 123746872
5,6,7,7a-Tetrahydrothieno[3,2-c]pyridine
CID 140555339
4,7-Dihydrothieno[2,3-b]pyridine 1-oxide
CID 140975134
6H-dithiolo[3,4-c]pyridine
CID 142421417
2,6-Dihydrothieno[2,3-c]pyridine
CID 150892864
4,7-dihydro-3H-dithiolo[3,4-b]pyridine
CID 169224140
1,7a-Dihydrothiopyrano[4,3-b]pyrrole
CID 173163881

Frequently Asked Questions

What is the IUPAC name of 5,7a-dihydrothieno[3,2-c]pyridine?
The IUPAC name of 5,7a-dihydrothieno[3,2-c]pyridine (CID 91319826) is 5,7a-dihydrothieno[3,2-c]pyridine.
What is the SMILES notation for 5,7a-dihydrothieno[3,2-c]pyridine?
The canonical SMILES for 5,7a-dihydrothieno[3,2-c]pyridine is C1=CC2SC=CC2=CN1.
What is the InChIKey of 5,7a-dihydrothieno[3,2-c]pyridine?
The InChIKey is CHNUGUJVGVXIGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NS/c1-3-8-5-6-2-4-9-7(1)6/h1-5,7-8H.
What are the key properties of 5,7a-dihydrothieno[3,2-c]pyridine?
5,7a-dihydrothieno[3,2-c]pyridine has a molecular weight of 137.21 g/mol, XLogP of 1.62, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7a-dihydrothieno[3,2-c]pyridine is sourced from PubChem (CID 91319826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).