1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione

C23H19NO4 — CID 122383154

IUPAC1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione
SMILESO=C(c1ccccc1)C(Cc1cccc2ccccc12)ON1C(=O)CCC1=O
InChIInChI=1S/C23H19NO4/c25-21-13-14-22(26)24(21)28-20(23(27)17-8-2-1-3-9-17)15-18-11-6-10-16-7-4-5-12-19(16)18/h1-12,20H,13-15H2
InChIKeyHEGRZMCEMGCXGL-UHFFFAOYSA-N
MW373.41 g/mol
LogP3.71
Rot. Bonds6

About 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione

1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione (PubChem CID 122383154) has the molecular formula C23H19NO4 and a molecular weight of 373.41 g/mol. Its IUPAC name is 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione
PubChem CID122383154
Molecular FormulaC23H19NO4
Molecular Weight373.41 g/mol
Exact Mass373.13
IUPAC Name1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione
SMILESO=C(c1ccccc1)C(Cc1cccc2ccccc12)ON1C(=O)CCC1=O
InChIInChI=1S/C23H19NO4/c25-21-13-14-22(26)24(21)28-20(23(27)17-8-2-1-3-9-17)15-18-11-6-10-16-7-4-5-12-19(16)18/h1-12,20H,13-15H2
InChIKeyHEGRZMCEMGCXGL-UHFFFAOYSA-N
XLogP3.71
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2,5-dioxopyrrolidin-1-yl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-naphthalen-1-ylpropanoate
CID 150626841
(2S)-2-(ethylcarbamoyloxy)-3-naphthalen-1-ylpropanoic acid
CID 70357471
2-(2-methylpropoxy)-3-naphthalen-1-ylpropanoic acid
CID 133245285
(2S)-3-naphthalen-1-yl-2-propoxypropanoic acid
CID 100531857
2-naphthalen-1-yl-1-phenylethanone
CID 10900926
methyl (2S)-2-amino-3-naphthalen-1-ylpropanoate
CID 18714238
(2S)-3-naphthalen-1-yl-2-(naphthalen-1-ylmethylamino)propanoic acid
CID 18728959
(2R)-2-(hydroxymethyl)-3-naphthalen-1-ylpropanoic acid
CID 10466391
2-formamido-3-naphthalen-1-ylpropanoic acid
CID 23093218
(2,5-dioxopyrrolidin-1-yl) N-methylcarbamate;ethane;phenanthrene
CID 161315751
(2R,4S)-1-naphthalen-1-yl-2,4-diphenoxy-5-phenylpentane-1,5-dione
CID 134836560
1,1-diiodoethane;1,3-diphenylpropane-1,3-dione;iodoethane;methane;naphthalen-1-ylmethanol;2-(naphthalen-1-ylmethyl)-1,3-diphenylpropane-1,3-dione
CID 160961994

Frequently Asked Questions

What is the IUPAC name of 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione?
The IUPAC name of 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione (CID 122383154) is 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione.
What is the SMILES notation for 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione?
The canonical SMILES for 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione is O=C(c1ccccc1)C(Cc1cccc2ccccc12)ON1C(=O)CCC1=O.
What is the InChIKey of 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione?
The InChIKey is HEGRZMCEMGCXGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO4/c25-21-13-14-22(26)24(21)28-20(23(27)17-8-2-1-3-9-17)15-18-11-6-10-16-7-4-5-12-19(16)18/h1-12,20H,13-15H2.
What are the key properties of 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione?
1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione has a molecular weight of 373.41 g/mol, XLogP of 3.71, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-naphthalen-1-yl-1-oxo-1-phenylpropan-2-yl)oxypyrrolidine-2,5-dione is sourced from PubChem (CID 122383154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).