(2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one

C14H17NO — CID 15468730

IUPAC(2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one
SMILESC[C@H](c1ccccc1)N1CC=CC(=O)[C@@H]1C
InChIInChI=1S/C14H17NO/c1-11(13-7-4-3-5-8-13)15-10-6-9-14(16)12(15)2/h3-9,11-12H,10H2,1-2H3/t11-,12+/m1/s1
InChIKeyONEVQUNSHSWSIU-NEPJUHHUSA-N
MW215.30 g/mol
LogP2.58
Rot. Bonds2

About (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one

(2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one (PubChem CID 15468730) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one.

Molecular Properties

Compound Name(2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one
PubChem CID15468730
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name(2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one
SMILESC[C@H](c1ccccc1)N1CC=CC(=O)[C@@H]1C
InChIInChI=1S/C14H17NO/c1-11(13-7-4-3-5-8-13)15-10-6-9-14(16)12(15)2/h3-9,11-12H,10H2,1-2H3/t11-,12+/m1/s1
InChIKeyONEVQUNSHSWSIU-NEPJUHHUSA-N
XLogP2.58
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-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

(2S)-2-methyl-1-[(1S)-1-phenylethyl]piperidin-4-one
CID 13198301
(2S)-2-methyl-1-(1-phenylethyl)piperidin-4-one
CID 69069233
2-methyl-1-[(1S)-1-phenylethyl]pyrrolidine
CID 141078428
(4S)-4-methyl-1-[(1S)-1-phenylethyl]azetidin-2-one
CID 11830202
(3R,4S)-3-deuterio-4-phenyl-1-[(1R)-1-phenylethyl]azetidin-2-one
CID 10538773
2-phenyl-1-[(1S)-1-phenylethyl]aziridine
CID 71369134
(2S,5S)-2,5-dimethyl-1-(1-phenylethyl)piperidine
CID 59989968
(1S,4R)-2-[(1R)-1-phenylethyl]-2-azabicyclo[2.2.1]heptan-6-one
CID 10703897
(2S,5R)-2,5-dimethyl-1-[(1S)-1-phenylethyl]pyrrolidine
CID 10976568
2-methyl-1-[(2S)-1-[(1S)-1-phenylethyl]aziridin-2-yl]propan-1-one
CID 131856193
2-methyl-1-[(2S)-1-[(1R)-1-phenylethyl]aziridin-2-yl]propan-1-one
CID 10965971
1-(1-phenylethyl)aziridine-2-carboxamide
CID 3891776

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one?
The IUPAC name of (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one (CID 15468730) is (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one.
What is the SMILES notation for (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one?
The canonical SMILES for (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one is C[C@H](c1ccccc1)N1CC=CC(=O)[C@@H]1C.
What is the InChIKey of (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one?
The InChIKey is ONEVQUNSHSWSIU-NEPJUHHUSA-N. The full InChI is InChI=1S/C14H17NO/c1-11(13-7-4-3-5-8-13)15-10-6-9-14(16)12(15)2/h3-9,11-12H,10H2,1-2H3/t11-,12+/m1/s1.
What are the key properties of (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one?
(2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one has a molecular weight of 215.30 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-1-[(1R)-1-phenylethyl]-2,6-dihydropyridin-3-one is sourced from PubChem (CID 15468730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).