3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one

C28H20N2O3 — CID 53311634

IUPAC3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one
SMILESO=C(/C=C/c1cccc(O)c1)n1c(-c2ccc3ccccc3c2)cn(-c2ccccc2)c1=O
InChIInChI=1S/C28H20N2O3/c31-25-12-6-7-20(17-25)13-16-27(32)30-26(19-29(28(30)33)24-10-2-1-3-11-24)23-15-14-21-8-4-5-9-22(21)18-23/h1-19,31H/b16-13+
InChIKeyFVLWYSMDNDYJOG-DTQAZKPQSA-N
MW432.48 g/mol
LogP5.52
Rot. Bonds4

About 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one

3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one (PubChem CID 53311634) has the molecular formula C28H20N2O3 and a molecular weight of 432.48 g/mol. Its IUPAC name is 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one.

Molecular Properties

Compound Name3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one
PubChem CID53311634
Molecular FormulaC28H20N2O3
Molecular Weight432.48 g/mol
Exact Mass432.15
IUPAC Name3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one
SMILESO=C(/C=C/c1cccc(O)c1)n1c(-c2ccc3ccccc3c2)cn(-c2ccccc2)c1=O
InChIInChI=1S/C28H20N2O3/c31-25-12-6-7-20(17-25)13-16-27(32)30-26(19-29(28(30)33)24-10-2-1-3-11-24)23-15-14-21-8-4-5-9-22(21)18-23/h1-19,31H/b16-13+
InChIKeyFVLWYSMDNDYJOG-DTQAZKPQSA-N
XLogP5.52
TPSA64.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.48
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-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

Related Compounds

1,4-diphenyl-3-[(E)-3-phenylprop-2-enoyl]imidazol-2-one
CID 53311379
4-(3,4-dimethoxyphenyl)-3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-1-phenylimidazol-2-one
CID 53311292
3-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-4-(3,4-dimethylphenyl)-1-phenylimidazol-2-one
CID 53311468
3-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-4-(3,4-dimethoxyphenyl)-1-phenylimidazol-2-one
CID 53311290
1-phenyl-3-[(E)-3-phenylprop-2-enoyl]-4-pyridin-3-ylimidazol-2-one
CID 53311973
3-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]-1-phenyl-4-thiophen-2-ylimidazol-2-one
CID 53311889
5-naphthalen-2-yl-3-[3-(3-phenylprop-2-enoyl)phenyl]-1H-imidazol-2-one
CID 67342786
3-[3-[3-(3-hydroxyphenyl)prop-2-enoyl]phenyl]-4-(4-methoxyphenyl)-1H-imidazol-2-one
CID 123163951
(Z)-4-(3-hydroxyphenyl)but-3-en-2-one
CID 97304849
3-[3-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]phenyl]-5-naphthalen-2-yl-1H-imidazol-2-one
CID 67340867
(E)-3-(6-hydroxynaphthalen-2-yl)-1-naphthalen-2-ylprop-2-en-1-one
CID 89077412
(E)-3-[3-(4-methoxyphenyl)phenyl]prop-2-enoic acid
CID 11161124

Frequently Asked Questions

What is the IUPAC name of 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one?
The IUPAC name of 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one (CID 53311634) is 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one.
What is the SMILES notation for 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one?
The canonical SMILES for 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one is O=C(/C=C/c1cccc(O)c1)n1c(-c2ccc3ccccc3c2)cn(-c2ccccc2)c1=O.
What is the InChIKey of 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one?
The InChIKey is FVLWYSMDNDYJOG-DTQAZKPQSA-N. The full InChI is InChI=1S/C28H20N2O3/c31-25-12-6-7-20(17-25)13-16-27(32)30-26(19-29(28(30)33)24-10-2-1-3-11-24)23-15-14-21-8-4-5-9-22(21)18-23/h1-19,31H/b16-13+.
What are the key properties of 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one?
3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one has a molecular weight of 432.48 g/mol, XLogP of 5.52, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-3-(3-hydroxyphenyl)prop-2-enoyl]-4-naphthalen-2-yl-1-phenylimidazol-2-one is sourced from PubChem (CID 53311634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).