4-(2-hydroxy-2-phenylethyl)morpholin-3-one

C12H15NO3 — CID 79469635

IUPAC4-(2-hydroxy-2-phenylethyl)morpholin-3-one
SMILESO=C1COCCN1CC(O)c1ccccc1
InChIInChI=1S/C12H15NO3/c14-11(10-4-2-1-3-5-10)8-13-6-7-16-9-12(13)15/h1-5,11,14H,6-9H2
InChIKeyWSNXLQDNFKIIST-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.58
Rot. Bonds3

About 4-(2-hydroxy-2-phenylethyl)morpholin-3-one

4-(2-hydroxy-2-phenylethyl)morpholin-3-one (PubChem CID 79469635) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is 4-(2-hydroxy-2-phenylethyl)morpholin-3-one.

Molecular Properties

Compound Name4-(2-hydroxy-2-phenylethyl)morpholin-3-one
PubChem CID79469635
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC Name4-(2-hydroxy-2-phenylethyl)morpholin-3-one
SMILESO=C1COCCN1CC(O)c1ccccc1
InChIInChI=1S/C12H15NO3/c14-11(10-4-2-1-3-5-10)8-13-6-7-16-9-12(13)15/h1-5,11,14H,6-9H2
InChIKeyWSNXLQDNFKIIST-UHFFFAOYSA-N
XLogP0.58
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(2-hydroxy-2-phenylethyl)morpholin-3-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

4-[2-hydroxy-2-[4-(2-methylpropyl)phenyl]ethyl]morpholin-3-one
CID 79467881
4-(3-amino-2-phenylpropyl)morpholin-3-one
CID 79468237
3-(3-oxomorpholin-4-yl)-2-phenylpropanethioamide
CID 79468813
4-[2-(1-benzofuran-2-yl)-2-hydroxyethyl]morpholin-3-one
CID 79468551
4-(2-hydroxy-2-phenylethyl)morpholine-3,5-dione
CID 61328165
3-[2-[4-[(2R)-2-hydroxy-2-phenylethyl]piperazin-1-yl]ethyl]-1,3-oxazolidin-2-one
CID 95602063
(2R)-1-[4-[(2R)-2-hydroxy-2-phenylethyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 95322241
(2S)-1-[4-[(2R)-2-hydroxy-2-phenylethyl]piperazin-1-yl]-3-morpholin-4-ylpropan-2-ol
CID 95322239
1-ethyl-4-(2-hydroxy-2-phenylethyl)piperazine-2,3-dione
CID 60886984
(5S)-5-tert-butyl-1-[(2S)-2-hydroxy-2-phenylethyl]azepan-2-one
CID 101253981
4-amino-1-[(2S)-2-hydroxy-2-phenylethyl]pyrrolidin-2-one
CID 168698967
4-[2-(ethylamino)-2-(4-methylphenyl)ethyl]morpholin-3-one
CID 79468530

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxy-2-phenylethyl)morpholin-3-one?
The IUPAC name of 4-(2-hydroxy-2-phenylethyl)morpholin-3-one (CID 79469635) is 4-(2-hydroxy-2-phenylethyl)morpholin-3-one.
What is the SMILES notation for 4-(2-hydroxy-2-phenylethyl)morpholin-3-one?
The canonical SMILES for 4-(2-hydroxy-2-phenylethyl)morpholin-3-one is O=C1COCCN1CC(O)c1ccccc1.
What is the InChIKey of 4-(2-hydroxy-2-phenylethyl)morpholin-3-one?
The InChIKey is WSNXLQDNFKIIST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c14-11(10-4-2-1-3-5-10)8-13-6-7-16-9-12(13)15/h1-5,11,14H,6-9H2.
What are the key properties of 4-(2-hydroxy-2-phenylethyl)morpholin-3-one?
4-(2-hydroxy-2-phenylethyl)morpholin-3-one has a molecular weight of 221.26 g/mol, XLogP of 0.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxy-2-phenylethyl)morpholin-3-one is sourced from PubChem (CID 79469635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).