2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide

C18H18FN3O4 — CID 174461287

About 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide

2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide (PubChem CID 174461287) has the molecular formula C18H18FN3O4 and a molecular weight of 359.36 g/mol. Its IUPAC name is 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide.

Molecular Properties

• Compound Name: 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide
• PubChem CID: 174461287
• Molecular Formula: C18H18FN3O4
• Molecular Weight: 359.36 g/mol
• Exact Mass: 359.13
• IUPAC Name: 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide
• SMILES: COc1ccc(-c2ccc(N3CC(C(C)C(N)=O)OC3=O)cc2F)cn1
• InChI: InChI=1S/C18H18FN3O4/c1-10(17(20)23)15-9-22(18(24)26-15)12-4-5-13(14(19)7-12)11-3-6-16(25-2)21-8-11/h3-8,10,15H,9H2,1-2H3,(H2,20,23)
• InChIKey: TWIGYSFPXNLXFN-UHFFFAOYSA-N
• XLogP: 2.34
• TPSA: 94.75 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	359.36
LogP ≤ 5	2.34
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide?

The IUPAC name of 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide (CID 174461287) is 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide.

What is the SMILES notation for 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide?

The canonical SMILES for 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide is COc1ccc(-c2ccc(N3CC(C(C)C(N)=O)OC3=O)cc2F)cn1.

What is the InChIKey of 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide?

The InChIKey is TWIGYSFPXNLXFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN3O4/c1-10(17(20)23)15-9-22(18(24)26-15)12-4-5-13(14(19)7-12)11-3-6-16(25-2)21-8-11/h3-8,10,15H,9H2,1-2H3,(H2,20,23).

What are the key properties of 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide?

2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide has a molecular weight of 359.36 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[3-[3-fluoro-4-(6-methoxy-3-pyridinyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]propanamide is sourced from PubChem (CID 174461287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).