2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid

C18H19FN2O5 — CID 119248343

About 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid

2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid (PubChem CID 119248343) has the molecular formula C18H19FN2O5 and a molecular weight of 362.36 g/mol. Its IUPAC name is 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid.

Molecular Properties

• Compound Name: 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid
• PubChem CID: 119248343
• Molecular Formula: C18H19FN2O5
• Molecular Weight: 362.36 g/mol
• Exact Mass: 362.13
• IUPAC Name: 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid
• SMILES: O=C(O)CC1CN(C(=O)CCc2ncc(-c3ccccc3F)o2)CCO1
• InChI: InChI=1S/C18H19FN2O5/c19-14-4-2-1-3-13(14)15-10-20-16(26-15)5-6-17(22)21-7-8-25-12(11-21)9-18(23)24/h1-4,10,12H,5-9,11H2,(H,23,24)
• InChIKey: GWABBWKTCALZAM-UHFFFAOYSA-N
• XLogP: 2.12
• TPSA: 92.87 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	362.36
LogP ≤ 5	2.12
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid?

The IUPAC name of 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid (CID 119248343) is 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid.

What is the SMILES notation for 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid?

The canonical SMILES for 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid is O=C(O)CC1CN(C(=O)CCc2ncc(-c3ccccc3F)o2)CCO1.

What is the InChIKey of 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid?

The InChIKey is GWABBWKTCALZAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O5/c19-14-4-2-1-3-13(14)15-10-20-16(26-15)5-6-17(22)21-7-8-25-12(11-21)9-18(23)24/h1-4,10,12H,5-9,11H2,(H,23,24).

What are the key properties of 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid?

2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid has a molecular weight of 362.36 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanoyl]morpholin-2-yl]acetic acid is sourced from PubChem (CID 119248343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).