6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone

C15H16N2O2S — CID 166385335

About 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone

6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone (PubChem CID 166385335) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone.

Molecular Properties

• Compound Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone
• PubChem CID: 166385335
• Molecular Formula: C15H16N2O2S
• Molecular Weight: 288.37 g/mol
• Exact Mass: 288.09
• IUPAC Name: 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone
• SMILES: COc1ccc(C)c(C(=O)N2CCc3sccc3C2)n1
• InChI: InChI=1S/C15H16N2O2S/c1-10-3-4-13(19-2)16-14(10)15(18)17-7-5-12-11(9-17)6-8-20-12/h3-4,6,8H,5,7,9H2,1-2H3
• InChIKey: ZICYZFOWXZEPRD-UHFFFAOYSA-N
• XLogP: 2.66
• TPSA: 42.43 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 2
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	288.37
LogP ≤ 5	2.66
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone?

The IUPAC name of 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone (CID 166385335) is 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone.

What is the SMILES notation for 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone?

The canonical SMILES for 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone is COc1ccc(C)c(C(=O)N2CCc3sccc3C2)n1.

What is the InChIKey of 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone?

The InChIKey is ZICYZFOWXZEPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-10-3-4-13(19-2)16-14(10)15(18)17-7-5-12-11(9-17)6-8-20-12/h3-4,6,8H,5,7,9H2,1-2H3.

What are the key properties of 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone?

6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone has a molecular weight of 288.37 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(6-methoxy-3-methyl-2-pyridinyl)methanone is sourced from PubChem (CID 166385335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).