N-(9-formyl-9H-fluoren-2-yl)propanamide

C₁₇H₁₅NO₂ — CID 89102901

About N-(9-formyl-9H-fluoren-2-yl)propanamide

N-(9-formyl-9H-fluoren-2-yl)propanamide (PubChem CID 89102901) has the molecular formula C₁₇H₁₅NO₂ and a molecular weight of 265.31 g/mol. Its IUPAC name is N-(9-formyl-9H-fluoren-2-yl)propanamide.

Molecular Properties

• Compound Name: N-(9-formyl-9H-fluoren-2-yl)propanamide
• PubChem CID: 89102901
• Molecular Formula: C₁₇H₁₅NO₂
• Molecular Weight: 265.31 g/mol
• Exact Mass: 265.11
• IUPAC Name: N-(9-formyl-9H-fluoren-2-yl)propanamide
• SMILES: CCC(=O)Nc1ccc2c(c1)C(C=O)c1ccccc1-2
• InChI: InChI=1S/C17H15NO2/c1-2-17(20)18-11-7-8-14-12-5-3-4-6-13(12)16(10-19)15(14)9-11/h3-10,16H,2H2,1H3,(H,18,20)
• InChIKey: WCUNMNJMCWIHSL-UHFFFAOYSA-N
• XLogP: 3.35
• TPSA: 46.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 3
• Heavy Atoms: 20
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	265.31
LogP ≤ 5	3.35
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(9-formyl-9H-fluoren-2-yl)propanamide?

The IUPAC name of N-(9-formyl-9H-fluoren-2-yl)propanamide (CID 89102901) is N-(9-formyl-9H-fluoren-2-yl)propanamide.

What is the SMILES notation for N-(9-formyl-9H-fluoren-2-yl)propanamide?

The canonical SMILES for N-(9-formyl-9H-fluoren-2-yl)propanamide is CCC(=O)Nc1ccc2c(c1)C(C=O)c1ccccc1-2.

What is the InChIKey of N-(9-formyl-9H-fluoren-2-yl)propanamide?

The InChIKey is WCUNMNJMCWIHSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-2-17(20)18-11-7-8-14-12-5-3-4-6-13(12)16(10-19)15(14)9-11/h3-10,16H,2H2,1H3,(H,18,20).

What are the key properties of N-(9-formyl-9H-fluoren-2-yl)propanamide?

N-(9-formyl-9H-fluoren-2-yl)propanamide has a molecular weight of 265.31 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-(9-formyl-9H-fluoren-2-yl)propanamide is sourced from PubChem (CID 89102901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 89102901 — identifiers, structure, computed properties (public domain)

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