N-(2-fluoroethoxy)benzamide

C₉H₁₀FNO₂ — CID 142724963

About N-(2-fluoroethoxy)benzamide

N-(2-fluoroethoxy)benzamide (PubChem CID 142724963) has the molecular formula C₉H₁₀FNO₂ and a molecular weight of 183.18 g/mol. Its IUPAC name is N-(2-fluoroethoxy)benzamide.

Molecular Properties

• Compound Name: N-(2-fluoroethoxy)benzamide
• PubChem CID: 142724963
• Molecular Formula: C₉H₁₀FNO₂
• Molecular Weight: 183.18 g/mol
• Exact Mass: 183.07
• IUPAC Name: N-(2-fluoroethoxy)benzamide
• SMILES: O=C(NOCCF)c1ccccc1
• InChI: InChI=1S/C9H10FNO2/c10-6-7-13-11-9(12)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)
• InChIKey: QTLNJYWPJPXERQ-UHFFFAOYSA-N
• XLogP: 1.32
• TPSA: 38.33 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 4
• Heavy Atoms: 13
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	183.18
LogP ≤ 5	1.32
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethoxy)benzamide?

The IUPAC name of N-(2-fluoroethoxy)benzamide (CID 142724963) is N-(2-fluoroethoxy)benzamide.

What is the SMILES notation for N-(2-fluoroethoxy)benzamide?

The canonical SMILES for N-(2-fluoroethoxy)benzamide is O=C(NOCCF)c1ccccc1.

What is the InChIKey of N-(2-fluoroethoxy)benzamide?

The InChIKey is QTLNJYWPJPXERQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO2/c10-6-7-13-11-9(12)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12).

What are the key properties of N-(2-fluoroethoxy)benzamide?

N-(2-fluoroethoxy)benzamide has a molecular weight of 183.18 g/mol, XLogP of 1.32, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-fluoroethoxy)benzamide is sourced from PubChem (CID 142724963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 142724963 — identifiers, structure, computed properties (public domain)

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