RIYVPRLCZRVXAM-UHFFFAOYSA-N

C₅H₆F₃N — CID 141473800

About RIYVPRLCZRVXAM-UHFFFAOYSA-N

RIYVPRLCZRVXAM-UHFFFAOYSA-N (PubChem CID 141473800) has the molecular formula C₅H₆F₃N and a molecular weight of 137.10 g/mol. Its IUPAC name is 1-(trifluoromethyl)-2,5-dihydropyrrole.

Molecular Properties

• Compound Name: RIYVPRLCZRVXAM-UHFFFAOYSA-N
• PubChem CID: 141473800
• Molecular Formula: C₅H₆F₃N
• Molecular Weight: 137.10 g/mol
• Exact Mass: 137.05
• IUPAC Name: 1-(trifluoromethyl)-2,5-dihydropyrrole
• SMILES: FC(F)(F)N1CC=CC1
• InChI: InChI=1S/C5H6F3N/c6-5(7,8)9-3-1-2-4-9/h1-2H,3-4H2
• InChIKey: RIYVPRLCZRVXAM-UHFFFAOYSA-N
• XLogP: 1.38
• TPSA: 3.24 Ų
• H-Bond Acceptors: 1
• Heavy Atoms: 9
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	137.10
LogP ≤ 5	1.38
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of RIYVPRLCZRVXAM-UHFFFAOYSA-N?

The IUPAC name of RIYVPRLCZRVXAM-UHFFFAOYSA-N (CID 141473800) is 1-(trifluoromethyl)-2,5-dihydropyrrole.

What is the SMILES notation for RIYVPRLCZRVXAM-UHFFFAOYSA-N?

The canonical SMILES for RIYVPRLCZRVXAM-UHFFFAOYSA-N is FC(F)(F)N1CC=CC1.

What is the InChIKey of RIYVPRLCZRVXAM-UHFFFAOYSA-N?

The InChIKey is RIYVPRLCZRVXAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F3N/c6-5(7,8)9-3-1-2-4-9/h1-2H,3-4H2.

What are the key properties of RIYVPRLCZRVXAM-UHFFFAOYSA-N?

RIYVPRLCZRVXAM-UHFFFAOYSA-N has a molecular weight of 137.10 g/mol, XLogP of 1.38, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for RIYVPRLCZRVXAM-UHFFFAOYSA-N is sourced from PubChem (CID 141473800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 141473800 — identifiers, structure, computed properties (public domain)

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