2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide

C17H19FN4O3 — CID 131895763

About 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide

2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide (PubChem CID 131895763) has the molecular formula C17H19FN4O3 and a molecular weight of 346.36 g/mol. Its IUPAC name is 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide.

Molecular Properties

• Compound Name: 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide
• PubChem CID: 131895763
• Molecular Formula: C17H19FN4O3
• Molecular Weight: 346.36 g/mol
• Exact Mass: 346.14
• IUPAC Name: 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide
• SMILES: CCCc1cc(CNC(=O)COCc2nc3ccc(F)cc3[nH]2)on1
• InChI: InChI=1S/C17H19FN4O3/c1-2-3-12-7-13(25-22-12)8-19-17(23)10-24-9-16-20-14-5-4-11(18)6-15(14)21-16/h4-7H,2-3,8-10H2,1H3,(H,19,23)(H,20,21)
• InChIKey: HBQVWOBVRVJAAK-UHFFFAOYSA-N
• XLogP: 2.48
• TPSA: 93.04 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	346.36
LogP ≤ 5	2.48
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide?

The IUPAC name of 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide (CID 131895763) is 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide.

What is the SMILES notation for 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide?

The canonical SMILES for 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide is CCCc1cc(CNC(=O)COCc2nc3ccc(F)cc3[nH]2)on1.

What is the InChIKey of 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide?

The InChIKey is HBQVWOBVRVJAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN4O3/c1-2-3-12-7-13(25-22-12)8-19-17(23)10-24-9-16-20-14-5-4-11(18)6-15(14)21-16/h4-7H,2-3,8-10H2,1H3,(H,19,23)(H,20,21).

What are the key properties of 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide?

2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide has a molecular weight of 346.36 g/mol, XLogP of 2.48, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(6-fluoro-1H-benzimidazol-2-yl)methoxy]-N-[(3-propyl-1,2-oxazol-5-yl)methyl]acetamide is sourced from PubChem (CID 131895763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).