1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione

C19H15NO3 — CID 141438458

IUPAC1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1c(O)cccc1C=CCc1ccccc1
InChIInChI=1S/C19H15NO3/c21-16-11-5-10-15(9-4-8-14-6-2-1-3-7-14)19(16)20-17(22)12-13-18(20)23/h1-7,9-13,21H,8H2
InChIKeySUFLVPALFQZONN-UHFFFAOYSA-N
MW305.33 g/mol
LogP3.08
Rot. Bonds4

About 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione

1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione (PubChem CID 141438458) has the molecular formula C19H15NO3 and a molecular weight of 305.33 g/mol. Its IUPAC name is 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione.

Molecular Properties

Compound Name1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione
PubChem CID141438458
Molecular FormulaC19H15NO3
Molecular Weight305.33 g/mol
Exact Mass305.11
IUPAC Name1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1c(O)cccc1C=CCc1ccccc1
InChIInChI=1S/C19H15NO3/c21-16-11-5-10-15(9-4-8-14-6-2-1-3-7-14)19(16)20-17(22)12-13-18(20)23/h1-7,9-13,21H,8H2
InChIKeySUFLVPALFQZONN-UHFFFAOYSA-N
XLogP3.08
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.33
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione with MolForge

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

Launch Full Analysis

Related Compounds

8-hydroxyquinolin-2(1H)-one
CID 97250
8-Hydroxy-4-methoxy-1-methylquinolin-2-one
CID 776146
(2E)-N-(2-hydroxyphenyl)-3-phenylprop-2-enamide
CID 5273475
5-[2-(dipropylamino)ethyl]-8-hydroxy-1H-quinolin-2-one
CID 20205476
8-hydroxy-5-[2-[2-(4-hydroxyphenyl)ethyl-propylamino]ethyl]-1H-quinolin-2-one
CID 44296669
8-hydroxy-5-[2-[2-phenylethyl(propyl)amino]ethyl]-1H-quinolin-2-one
CID 44296690
3-Hydroxy-cinnamanilide
CID 71718276
Viridicatol
CID 115033
(8-Hydroxy-2-oxo-2H-quinolin-1-yl)-acetic acid
CID 13683079
8-hydroxy-5-[2-[2-(4-hydroxyphenyl)ethylamino]ethyl]-1H-quinolin-2-one
CID 44296679
(E)-N-(2-hydroxyphenyl)-3-(3-hydroxyphenyl)prop-2-enamide
CID 71559653
(E)-3-(3-hydroxyphenyl)-N-(2-methylphenyl)prop-2-enamide
CID 71559766

Frequently Asked Questions

What is the IUPAC name of 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione?
The IUPAC name of 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione (CID 141438458) is 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione.
What is the SMILES notation for 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione?
The canonical SMILES for 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione is O=C1C=CC(=O)N1c1c(O)cccc1C=CCc1ccccc1.
What is the InChIKey of 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione?
The InChIKey is SUFLVPALFQZONN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO3/c21-16-11-5-10-15(9-4-8-14-6-2-1-3-7-14)19(16)20-17(22)12-13-18(20)23/h1-7,9-13,21H,8H2.
What are the key properties of 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione?
1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione has a molecular weight of 305.33 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-hydroxy-6-(3-phenylprop-1-enyl)phenyl]pyrrole-2,5-dione is sourced from PubChem (CID 141438458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).