1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione

C20H17FN2O3 — CID 110560663

IUPAC1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione
SMILESO=C1C(c2ccccc2)=C(N2CCOCC2)C(=O)N1c1ccccc1F
InChIInChI=1S/C20H17FN2O3/c21-15-8-4-5-9-16(15)23-19(24)17(14-6-2-1-3-7-14)18(20(23)25)22-10-12-26-13-11-22/h1-9H,10-13H2
InChIKeyAPUDIOMBSMWUMG-UHFFFAOYSA-N
MW352.37 g/mol
LogP2.44
Rot. Bonds3

About 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione

1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione (PubChem CID 110560663) has the molecular formula C20H17FN2O3 and a molecular weight of 352.37 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione
PubChem CID110560663
Molecular FormulaC20H17FN2O3
Molecular Weight352.37 g/mol
Exact Mass352.12
IUPAC Name1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione
SMILESO=C1C(c2ccccc2)=C(N2CCOCC2)C(=O)N1c1ccccc1F
InChIInChI=1S/C20H17FN2O3/c21-15-8-4-5-9-16(15)23-19(24)17(14-6-2-1-3-7-14)18(20(23)25)22-10-12-26-13-11-22/h1-9H,10-13H2
InChIKeyAPUDIOMBSMWUMG-UHFFFAOYSA-N
XLogP2.44
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.37
LogP ≤ 52.44
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

1-(2-fluorophenyl)-3-(4-methylpiperidin-1-yl)-4-phenylpyrrole-2,5-dione
CID 110560657
1-(4-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione
CID 110560474
1-(2-fluorophenyl)-3-(4-fluorophenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrrole-2,5-dione
CID 110544804
1-(4-chloro-2-methylphenyl)-3-(4-fluorophenyl)-4-morpholin-4-ylpyrrole-2,5-dione
CID 110545675
1-(3-bromophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione
CID 110560399
3-(4-methoxyphenyl)-1-(2-methylphenyl)-4-morpholin-4-ylpyrrole-2,5-dione
CID 110558108
3-(4-chlorophenyl)-4-(4-ethylpiperazin-1-yl)-1-(2-fluorophenyl)pyrrole-2,5-dione
CID 110570511
1-(2-fluorophenyl)-3-(4-methoxyphenyl)-4-(4-methylpiperidin-1-yl)pyrrole-2,5-dione
CID 110557240
1-ethyl-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione
CID 110559416
N-[4-[1-(2-methylphenyl)-4-morpholin-4-yl-2,5-dioxopyrrol-3-yl]phenyl]acetamide
CID 110563681
1-[4-chloro-3-(trifluoromethyl)phenyl]-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione
CID 110560423
1-(2,5-dimethylphenyl)-3-(4-fluorophenyl)-4-morpholin-4-ylpyrrole-2,5-dione
CID 110545042

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione?
The IUPAC name of 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione (CID 110560663) is 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione.
What is the SMILES notation for 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione?
The canonical SMILES for 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione is O=C1C(c2ccccc2)=C(N2CCOCC2)C(=O)N1c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione?
The InChIKey is APUDIOMBSMWUMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN2O3/c21-15-8-4-5-9-16(15)23-19(24)17(14-6-2-1-3-7-14)18(20(23)25)22-10-12-26-13-11-22/h1-9H,10-13H2.
What are the key properties of 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione?
1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione has a molecular weight of 352.37 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-morpholin-4-yl-4-phenylpyrrole-2,5-dione is sourced from PubChem (CID 110560663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).