N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide

C19H18FN3O3 — CID 110335037

About N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide

N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide (PubChem CID 110335037) has the molecular formula C19H18FN3O3 and a molecular weight of 355.37 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide.

Molecular Properties

• Compound Name: N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide
• PubChem CID: 110335037
• Molecular Formula: C19H18FN3O3
• Molecular Weight: 355.37 g/mol
• Exact Mass: 355.13
• IUPAC Name: N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide
• SMILES: COc1ccc(-c2nnc(CCC(=O)NCc3ccccc3F)o2)cc1
• InChI: InChI=1S/C19H18FN3O3/c1-25-15-8-6-13(7-9-15)19-23-22-18(26-19)11-10-17(24)21-12-14-4-2-3-5-16(14)20/h2-9H,10-12H2,1H3,(H,21,24)
• InChIKey: LLRGEDOINPHHSD-UHFFFAOYSA-N
• XLogP: 3.13
• TPSA: 77.25 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 7
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	355.37
LogP ≤ 5	3.13
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide?

The IUPAC name of N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide (CID 110335037) is N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide.

What is the SMILES notation for N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide?

The canonical SMILES for N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide is COc1ccc(-c2nnc(CCC(=O)NCc3ccccc3F)o2)cc1.

What is the InChIKey of N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide?

The InChIKey is LLRGEDOINPHHSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O3/c1-25-15-8-6-13(7-9-15)19-23-22-18(26-19)11-10-17(24)21-12-14-4-2-3-5-16(14)20/h2-9H,10-12H2,1H3,(H,21,24).

What are the key properties of N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide?

N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide has a molecular weight of 355.37 g/mol, XLogP of 3.13, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2-fluorophenyl)methyl]-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide is sourced from PubChem (CID 110335037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).