Beclamide

C₁₀H₁₂ClNO — CID 10391

About Beclamide

Beclamide (PubChem CID 10391) has the molecular formula C₁₀H₁₂ClNO and a molecular weight of 197.67 g/mol. Its IUPAC name is N-benzyl-3-chloropropanamide.

Molecular Properties

• Compound Name: Beclamide
• PubChem CID: 10391
• Molecular Formula: C₁₀H₁₂ClNO
• Molecular Weight: 197.67 g/mol
• Exact Mass: 197.06
• IUPAC Name: N-benzyl-3-chloropropanamide
• SMILES: O=C(CCCl)NCc1ccccc1
• InChI: InChI=1S/C10H12ClNO/c11-7-6-10(13)12-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,12,13)
• InChIKey: JPYQFYIEOUVJDU-UHFFFAOYSA-N
• XLogP: 1.93
• TPSA: 29.10 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 1
• Rotatable Bonds: 4
• Heavy Atoms: 13
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	197.67
LogP ≤ 5	1.93
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of Beclamide?

The IUPAC name of Beclamide (CID 10391) is N-benzyl-3-chloropropanamide.

What is the SMILES notation for Beclamide?

The canonical SMILES for Beclamide is O=C(CCCl)NCc1ccccc1.

What is the InChIKey of Beclamide?

The InChIKey is JPYQFYIEOUVJDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO/c11-7-6-10(13)12-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,12,13).

What are the key properties of Beclamide?

Beclamide has a molecular weight of 197.67 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for Beclamide is sourced from PubChem (CID 10391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 10391 — identifiers, structure, computed properties (public domain)
• DrugCentral drug card 291 — approved-drug record (CC BY-SA 4.0)

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