5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine

C12H10N2S — CID 143216102

IUPAC5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine
SMILESC1=CC2N=C(c3ccccn3)C=CC2S1
InChIInChI=1S/C12H10N2S/c1-2-7-13-9(3-1)10-4-5-12-11(14-10)6-8-15-12/h1-8,11-12H
InChIKeyPLEWDJTVJPYBBG-UHFFFAOYSA-N
MW214.29 g/mol
LogP2.44
Rot. Bonds1

About 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine

5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine (PubChem CID 143216102) has the molecular formula C12H10N2S and a molecular weight of 214.29 g/mol. Its IUPAC name is 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine.

Molecular Properties

Compound Name5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine
PubChem CID143216102
Molecular FormulaC12H10N2S
Molecular Weight214.29 g/mol
Exact Mass214.06
IUPAC Name5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine
SMILESC1=CC2N=C(c3ccccn3)C=CC2S1
InChIInChI=1S/C12H10N2S/c1-2-7-13-9(3-1)10-4-5-12-11(14-10)6-8-15-12/h1-8,11-12H
InChIKeyPLEWDJTVJPYBBG-UHFFFAOYSA-N
XLogP2.44
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine?
The IUPAC name of 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine (CID 143216102) is 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine.
What is the SMILES notation for 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine?
The canonical SMILES for 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine is C1=CC2N=C(c3ccccn3)C=CC2S1.
What is the InChIKey of 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine?
The InChIKey is PLEWDJTVJPYBBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2S/c1-2-7-13-9(3-1)10-4-5-12-11(14-10)6-8-15-12/h1-8,11-12H.
What are the key properties of 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine?
5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine has a molecular weight of 214.29 g/mol, XLogP of 2.44, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-2-yl-3a,7a-dihydrothieno[3,2-b]pyridine is sourced from PubChem (CID 143216102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).