(2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide

C19H19FN2O3 — CID 96526165

IUPAC(2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide
SMILESCO[C@H](C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O)c1ccccc1
InChIInChI=1S/C19H19FN2O3/c1-25-17(13-7-3-2-4-8-13)18(23)21-15-11-12-22(19(15)24)16-10-6-5-9-14(16)20/h2-10,15,17H,11-12H2,1H3,(H,21,23)/t15-,17+/m1/s1
InChIKeyMVEXNLKWGZFXPD-WBVHZDCISA-N
MW342.37 g/mol
LogP2.43
Rot. Bonds5

About (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide

(2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide (PubChem CID 96526165) has the molecular formula C19H19FN2O3 and a molecular weight of 342.37 g/mol. Its IUPAC name is (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide
PubChem CID96526165
Molecular FormulaC19H19FN2O3
Molecular Weight342.37 g/mol
Exact Mass342.14
IUPAC Name(2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide
SMILESCO[C@H](C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O)c1ccccc1
InChIInChI=1S/C19H19FN2O3/c1-25-17(13-7-3-2-4-8-13)18(23)21-15-11-12-22(19(15)24)16-10-6-5-9-14(16)20/h2-10,15,17H,11-12H2,1H3,(H,21,23)/t15-,17+/m1/s1
InChIKeyMVEXNLKWGZFXPD-WBVHZDCISA-N
XLogP2.43
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.37
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide?
The IUPAC name of (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide (CID 96526165) is (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide.
What is the SMILES notation for (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide?
The canonical SMILES for (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide is CO[C@H](C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O)c1ccccc1.
What is the InChIKey of (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide?
The InChIKey is MVEXNLKWGZFXPD-WBVHZDCISA-N. The full InChI is InChI=1S/C19H19FN2O3/c1-25-17(13-7-3-2-4-8-13)18(23)21-15-11-12-22(19(15)24)16-10-6-5-9-14(16)20/h2-10,15,17H,11-12H2,1H3,(H,21,23)/t15-,17+/m1/s1.
What are the key properties of (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide?
(2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide has a molecular weight of 342.37 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[(3R)-1-(2-fluorophenyl)-2-oxopyrrolidin-3-yl]-2-methoxy-2-phenylacetamide is sourced from PubChem (CID 96526165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).