(2S)-4-phenylpyrrolidine-2-carboxamide

C₁₁H₁₄N₂O — CID 171062215

About (2S)-4-phenylpyrrolidine-2-carboxamide

(2S)-4-phenylpyrrolidine-2-carboxamide (PubChem CID 171062215) has the molecular formula C₁₁H₁₄N₂O and a molecular weight of 190.25 g/mol. Its IUPAC name is (2S)-4-phenylpyrrolidine-2-carboxamide.

Molecular Properties

• Compound Name: (2S)-4-phenylpyrrolidine-2-carboxamide
• PubChem CID: 171062215
• Molecular Formula: C₁₁H₁₄N₂O
• Molecular Weight: 190.25 g/mol
• Exact Mass: 190.11
• IUPAC Name: (2S)-4-phenylpyrrolidine-2-carboxamide
• SMILES: NC(=O)[C@@H]1CC(c2ccccc2)CN1
• InChI: InChI=1S/C11H14N2O/c12-11(14)10-6-9(7-13-10)8-4-2-1-3-5-8/h1-5,9-10,13H,6-7H2,(H2,12,14)/t9?,10-/m0/s1
• InChIKey: FIMSVGSMVREODS-AXDSSHIGSA-N
• XLogP: 0.62
• TPSA: 55.12 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 2
• Rotatable Bonds: 2
• Heavy Atoms: 14
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	190.25
LogP ≤ 5	0.62
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of (2S)-4-phenylpyrrolidine-2-carboxamide?

The IUPAC name of (2S)-4-phenylpyrrolidine-2-carboxamide (CID 171062215) is (2S)-4-phenylpyrrolidine-2-carboxamide.

What is the SMILES notation for (2S)-4-phenylpyrrolidine-2-carboxamide?

The canonical SMILES for (2S)-4-phenylpyrrolidine-2-carboxamide is NC(=O)[C@@H]1CC(c2ccccc2)CN1.

What is the InChIKey of (2S)-4-phenylpyrrolidine-2-carboxamide?

The InChIKey is FIMSVGSMVREODS-AXDSSHIGSA-N. The full InChI is InChI=1S/C11H14N2O/c12-11(14)10-6-9(7-13-10)8-4-2-1-3-5-8/h1-5,9-10,13H,6-7H2,(H2,12,14)/t9?,10-/m0/s1.

What are the key properties of (2S)-4-phenylpyrrolidine-2-carboxamide?

(2S)-4-phenylpyrrolidine-2-carboxamide has a molecular weight of 190.25 g/mol, XLogP of 0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for (2S)-4-phenylpyrrolidine-2-carboxamide is sourced from PubChem (CID 171062215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 171062215 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.