(6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione

C13H15NO3 — CID 10955462

IUPAC(6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione
SMILESC[C@@H]1OC(=O)CN([C@@H](C)c2ccccc2)C1=O
InChIInChI=1S/C13H15NO3/c1-9(11-6-4-3-5-7-11)14-8-12(15)17-10(2)13(14)16/h3-7,9-10H,8H2,1-2H3/t9-,10-/m0/s1
InChIKeyCPLRCYRMTVRFAP-UWVGGRQHSA-N
MW233.27 g/mol
LogP1.52
Rot. Bonds2

About (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione

(6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione (PubChem CID 10955462) has the molecular formula C13H15NO3 and a molecular weight of 233.27 g/mol. Its IUPAC name is (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione.

Molecular Properties

Compound Name(6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione
PubChem CID10955462
Molecular FormulaC13H15NO3
Molecular Weight233.27 g/mol
Exact Mass233.11
IUPAC Name(6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione
SMILESC[C@@H]1OC(=O)CN([C@@H](C)c2ccccc2)C1=O
InChIInChI=1S/C13H15NO3/c1-9(11-6-4-3-5-7-11)14-8-12(15)17-10(2)13(14)16/h3-7,9-10H,8H2,1-2H3/t9-,10-/m0/s1
InChIKeyCPLRCYRMTVRFAP-UWVGGRQHSA-N
XLogP1.52
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-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

3-methyl-1-[(1R)-1-phenylethyl]pyrrolidin-2-one
CID 142649009
4-methyl-1-[(1S)-1-phenylethyl]piperidin-2-one
CID 53382448
3,4,4-trimethyl-1-[(1R)-1-phenylethyl]pyrrolidin-2-one
CID 70991873
(3R)-3-methyl-1-[(1R)-1-phenylethyl]azepan-2-one
CID 14813890
2-(1-phenylethyl)-3,6,7,8,9,9a-hexahydropyrido[1,2-a]pyrazine-1,4-dione
CID 79929079
5-(1-phenylethyl)-3,3a,6,6a-tetrahydro-1H-furo[3,4-c]pyrrol-4-one
CID 143715156
3,4-dimethyl-1-(1-phenylethyl)-2H-pyrrol-5-one
CID 20820546
3-hydroxy-1-[(1R)-1-phenylethyl]-4-propan-2-ylpyrrolidin-2-one
CID 58335409
3,7-bis[(1R)-1-phenylethyl]-3,7-diazabicyclo[3.3.1]nonane-2,4,6,8-tetrone
CID 134961753
4-(1-phenylethyl)-1,3-dihydroquinoxalin-2-one
CID 117006573
(3aR,7aR)-2-[(1R)-1-phenylethyl]-1,3a,4,6,7,7a-hexahydropyrano[3,4-c]pyrrol-3-one
CID 143715244
(3S)-3-(hydroxymethyl)-1-[(1R)-1-phenylethyl]pyrrolidin-2-one
CID 118420929

Frequently Asked Questions

What is the IUPAC name of (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione?
The IUPAC name of (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione (CID 10955462) is (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione.
What is the SMILES notation for (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione?
The canonical SMILES for (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione is C[C@@H]1OC(=O)CN([C@@H](C)c2ccccc2)C1=O.
What is the InChIKey of (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione?
The InChIKey is CPLRCYRMTVRFAP-UWVGGRQHSA-N. The full InChI is InChI=1S/C13H15NO3/c1-9(11-6-4-3-5-7-11)14-8-12(15)17-10(2)13(14)16/h3-7,9-10H,8H2,1-2H3/t9-,10-/m0/s1.
What are the key properties of (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione?
(6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione has a molecular weight of 233.27 g/mol, XLogP of 1.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-6-methyl-4-[(1S)-1-phenylethyl]morpholine-2,5-dione is sourced from PubChem (CID 10955462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).