3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one

C23H18FNO3 — CID 171480802

IUPAC3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one
SMILESO=C1C(c2ccccc2F)=CC(O)(c2ccccc2)N1OCc1ccccc1
InChIInChI=1S/C23H18FNO3/c24-21-14-8-7-13-19(21)20-15-23(27,18-11-5-2-6-12-18)25(22(20)26)28-16-17-9-3-1-4-10-17/h1-15,27H,16H2
InChIKeyNXKBTSRECZJQMT-UHFFFAOYSA-N
MW375.40 g/mol
LogP4.03
Rot. Bonds5

About 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one

3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one (PubChem CID 171480802) has the molecular formula C23H18FNO3 and a molecular weight of 375.40 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one.

Molecular Properties

Compound Name3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one
PubChem CID171480802
Molecular FormulaC23H18FNO3
Molecular Weight375.40 g/mol
Exact Mass375.13
IUPAC Name3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one
SMILESO=C1C(c2ccccc2F)=CC(O)(c2ccccc2)N1OCc1ccccc1
InChIInChI=1S/C23H18FNO3/c24-21-14-8-7-13-19(21)20-15-23(27,18-11-5-2-6-12-18)25(22(20)26)28-16-17-9-3-1-4-10-17/h1-15,27H,16H2
InChIKeyNXKBTSRECZJQMT-UHFFFAOYSA-N
XLogP4.03
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.40
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one?
The IUPAC name of 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one (CID 171480802) is 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one.
What is the SMILES notation for 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one?
The canonical SMILES for 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one is O=C1C(c2ccccc2F)=CC(O)(c2ccccc2)N1OCc1ccccc1.
What is the InChIKey of 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one?
The InChIKey is NXKBTSRECZJQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FNO3/c24-21-14-8-7-13-19(21)20-15-23(27,18-11-5-2-6-12-18)25(22(20)26)28-16-17-9-3-1-4-10-17/h1-15,27H,16H2.
What are the key properties of 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one?
3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one has a molecular weight of 375.40 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-5-hydroxy-5-phenyl-1-phenylmethoxypyrrol-2-one is sourced from PubChem (CID 171480802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).