2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide

C18H22N2O4S — CID 167816970

About 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide

2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide (PubChem CID 167816970) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide.

Molecular Properties

• Compound Name: 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide
• PubChem CID: 167816970
• Molecular Formula: C18H22N2O4S
• Molecular Weight: 362.45 g/mol
• Exact Mass: 362.13
• IUPAC Name: 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide
• SMILES: COc1ccc(COCC(=O)NCC2(C)OCCc3sccc32)cn1
• InChI: InChI=1S/C18H22N2O4S/c1-18(14-6-8-25-15(14)5-7-24-18)12-20-16(21)11-23-10-13-3-4-17(22-2)19-9-13/h3-4,6,8-9H,5,7,10-12H2,1-2H3,(H,20,21)
• InChIKey: NDPMRHQAKWFTFJ-UHFFFAOYSA-N
• XLogP: 2.27
• TPSA: 69.68 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	362.45
LogP ≤ 5	2.27
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide?

The IUPAC name of 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide (CID 167816970) is 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide.

What is the SMILES notation for 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide?

The canonical SMILES for 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide is COc1ccc(COCC(=O)NCC2(C)OCCc3sccc32)cn1.

What is the InChIKey of 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide?

The InChIKey is NDPMRHQAKWFTFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-18(14-6-8-25-15(14)5-7-24-18)12-20-16(21)11-23-10-13-3-4-17(22-2)19-9-13/h3-4,6,8-9H,5,7,10-12H2,1-2H3,(H,20,21).

What are the key properties of 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide?

2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide has a molecular weight of 362.45 g/mol, XLogP of 2.27, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide is sourced from PubChem (CID 167816970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).