5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione

C16H15N3O4 — CID 121267063

IUPAC5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione
SMILESCc1c(CC2(c3cccc(O)c3)NC(=O)NC2=O)cc[nH]c1=O
InChIInChI=1S/C16H15N3O4/c1-9-10(5-6-17-13(9)21)8-16(14(22)18-15(23)19-16)11-3-2-4-12(20)7-11/h2-7,20H,8H2,1H3,(H,17,21)(H2,18,19,22,23)
InChIKeyNRWLWFRXTBMYHT-UHFFFAOYSA-N
MW313.31 g/mol
LogP0.67
Rot. Bonds3

About 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione

5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione (PubChem CID 121267063) has the molecular formula C16H15N3O4 and a molecular weight of 313.31 g/mol. Its IUPAC name is 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione
PubChem CID121267063
Molecular FormulaC16H15N3O4
Molecular Weight313.31 g/mol
Exact Mass313.11
IUPAC Name5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione
SMILESCc1c(CC2(c3cccc(O)c3)NC(=O)NC2=O)cc[nH]c1=O
InChIInChI=1S/C16H15N3O4/c1-9-10(5-6-17-13(9)21)8-16(14(22)18-15(23)19-16)11-3-2-4-12(20)7-11/h2-7,20H,8H2,1H3,(H,17,21)(H2,18,19,22,23)
InChIKeyNRWLWFRXTBMYHT-UHFFFAOYSA-N
XLogP0.67
TPSA111.29 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.31
LogP ≤ 50.67
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione 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 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione?
The IUPAC name of 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione (CID 121267063) is 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione is Cc1c(CC2(c3cccc(O)c3)NC(=O)NC2=O)cc[nH]c1=O.
What is the InChIKey of 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione?
The InChIKey is NRWLWFRXTBMYHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O4/c1-9-10(5-6-17-13(9)21)8-16(14(22)18-15(23)19-16)11-3-2-4-12(20)7-11/h2-7,20H,8H2,1H3,(H,17,21)(H2,18,19,22,23).
What are the key properties of 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione?
5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione has a molecular weight of 313.31 g/mol, XLogP of 0.67, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-hydroxyphenyl)-5-[(3-methyl-2-oxo-1H-pyridin-4-yl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 121267063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).