3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione

C12H14N2O3 — CID 107861540

IUPAC3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1[C@@H](CO)Cc1ccccc1
InChIInChI=1S/C12H14N2O3/c15-8-10(6-9-4-2-1-3-5-9)14-11(16)7-13-12(14)17/h1-5,10,15H,6-8H2,(H,13,17)/t10-/m1/s1
InChIKeyGQVMORKLJVTYEL-SNVBAGLBSA-N
MW234.25 g/mol
LogP0.14
Rot. Bonds4

About 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione

3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione (PubChem CID 107861540) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione
PubChem CID107861540
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione
SMILESO=C1CNC(=O)N1[C@@H](CO)Cc1ccccc1
InChIInChI=1S/C12H14N2O3/c15-8-10(6-9-4-2-1-3-5-9)14-11(16)7-13-12(14)17/h1-5,10,15H,6-8H2,(H,13,17)/t10-/m1/s1
InChIKeyGQVMORKLJVTYEL-SNVBAGLBSA-N
XLogP0.14
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-[(2R)-1-hydroxy-3-phenylpropan-2-yl]azepane-2,7-dione
CID 107861522
4-(1-hydroxy-3-phenylpropan-2-yl)thiomorpholine-3,5-dione
CID 104570912
3-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-3-azabicyclo[3.1.0]hexane-2,4-dione
CID 114010352
3-[(2S)-1-hydroxybutan-2-yl]imidazolidine-2,4-dione
CID 107861614
1-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-3,4-dimethylpyrrole-2,5-dione
CID 107861517
1-[(2R)-1-hydroxy-3-phenylpropan-2-yl]pyrrolidin-2-one
CID 107861552
1-(1-hydroxy-3-phenylpropan-2-yl)-4-sulfanylpyrrolidin-2-one
CID 168707836
4-(bromomethyl)-1-(1-hydroxy-3-phenylpropan-2-yl)pyrrolidin-2-one
CID 168503437
(2S)-2-(3-methylazetidin-1-yl)-3-phenylpropan-1-ol
CID 107863697
1-(1-hydroxy-3-phenylpropan-2-yl)-5-oxopyrrolidine-3-sulfonamide
CID 168716672
2-(1,3-dihydroisoindol-2-yl)-3-phenylpropan-1-ol
CID 72965520
(2S)-3-phenyl-2-(3-propan-2-ylazetidin-1-yl)propan-1-ol
CID 107863705

Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione?
The IUPAC name of 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione (CID 107861540) is 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione.
What is the SMILES notation for 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione?
The canonical SMILES for 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione is O=C1CNC(=O)N1[C@@H](CO)Cc1ccccc1.
What is the InChIKey of 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione?
The InChIKey is GQVMORKLJVTYEL-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H14N2O3/c15-8-10(6-9-4-2-1-3-5-9)14-11(16)7-13-12(14)17/h1-5,10,15H,6-8H2,(H,13,17)/t10-/m1/s1.
What are the key properties of 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione?
3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione has a molecular weight of 234.25 g/mol, XLogP of 0.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-1-hydroxy-3-phenylpropan-2-yl]imidazolidine-2,4-dione is sourced from PubChem (CID 107861540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).