1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione

C13H15NO3 — CID 107863789

IUPAC1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione
SMILESO=C1CCCC(=O)N1[C@@H](CO)c1ccccc1
InChIInChI=1S/C13H15NO3/c15-9-11(10-5-2-1-3-6-10)14-12(16)7-4-8-13(14)17/h1-3,5-6,11,15H,4,7-9H2/t11-/m0/s1
InChIKeySOPBSAGLDJRAPR-NSHDSACASA-N
MW233.27 g/mol
LogP1.26
Rot. Bonds3

About 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione

1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione (PubChem CID 107863789) has the molecular formula C13H15NO3 and a molecular weight of 233.27 g/mol. Its IUPAC name is 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione.

Molecular Properties

Compound Name1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione
PubChem CID107863789
Molecular FormulaC13H15NO3
Molecular Weight233.27 g/mol
Exact Mass233.11
IUPAC Name1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione
SMILESO=C1CCCC(=O)N1[C@@H](CO)c1ccccc1
InChIInChI=1S/C13H15NO3/c15-9-11(10-5-2-1-3-6-10)14-12(16)7-4-8-13(14)17/h1-3,5-6,11,15H,4,7-9H2/t11-/m0/s1
InChIKeySOPBSAGLDJRAPR-NSHDSACASA-N
XLogP1.26
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-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

1-[(1S)-2-hydroxy-1-phenylethyl]pyrrolidine-2,5-dione
CID 71354940
8-[(1R)-2-hydroxy-1-phenylethyl]-8-azaspiro[4.5]decane-7,9-dione
CID 107863747
1-[(1R)-2-hydroxy-1-phenylethyl]-4-methylpiperidine-2,6-dione
CID 95027251
1-(2-hydroxy-1-phenylethyl)-1,3-diazinane-2,4,6-trione
CID 70627664
ethyl 1-[(1S)-2-hydroxy-1-phenylethyl]-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylate
CID 101250288
1-[(2R)-1-hydroxy-3-phenylpropan-2-yl]azepane-2,7-dione
CID 107861522
(4S)-1'-[(1R)-2-hydroxy-1-phenylethyl]spiro[2,3-dihydro-1H-naphthalene-4,6'-piperidine]-2'-one
CID 11759472
3-[(1S)-2-hydroxy-1-phenylethyl]-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2,4-dione
CID 107863631
1-[(1R)-2-hydroxy-1-phenylethyl]-3-methylpyrrole-2,5-dione
CID 107863751
(5S)-1-(2-hydroxy-1-phenylethyl)-5-methylpiperidin-2-one
CID 175215749
1-[(1R)-2-hydroxy-1-phenylethyl]imidazolidin-2-one
CID 107863748
2-(2,7-dioxoazepan-1-yl)-3-phenylpropanoic acid
CID 43446699

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione?
The IUPAC name of 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione (CID 107863789) is 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione.
What is the SMILES notation for 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione?
The canonical SMILES for 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione is O=C1CCCC(=O)N1[C@@H](CO)c1ccccc1.
What is the InChIKey of 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione?
The InChIKey is SOPBSAGLDJRAPR-NSHDSACASA-N. The full InChI is InChI=1S/C13H15NO3/c15-9-11(10-5-2-1-3-6-10)14-12(16)7-4-8-13(14)17/h1-3,5-6,11,15H,4,7-9H2/t11-/m0/s1.
What are the key properties of 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione?
1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione has a molecular weight of 233.27 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-2-hydroxy-1-phenylethyl]piperidine-2,6-dione is sourced from PubChem (CID 107863789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).