(5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione

C19H18N2O4 — CID 39026900

IUPAC(5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione
SMILESCOc1ccccc1C(=O)CN1C(=O)[C@H](C)N(c2ccccc2)C1=O
InChIInChI=1S/C19H18N2O4/c1-13-18(23)20(19(24)21(13)14-8-4-3-5-9-14)12-16(22)15-10-6-7-11-17(15)25-2/h3-11,13H,12H2,1-2H3/t13-/m0/s1
InChIKeyPZEYLBJHHVQJNH-ZDUSSCGKSA-N
MW338.36 g/mol
LogP2.74
Rot. Bonds5

About (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione

(5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione (PubChem CID 39026900) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione
PubChem CID39026900
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC Name(5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione
SMILESCOc1ccccc1C(=O)CN1C(=O)[C@H](C)N(c2ccccc2)C1=O
InChIInChI=1S/C19H18N2O4/c1-13-18(23)20(19(24)21(13)14-8-4-3-5-9-14)12-16(22)15-10-6-7-11-17(15)25-2/h3-11,13H,12H2,1-2H3/t13-/m0/s1
InChIKeyPZEYLBJHHVQJNH-ZDUSSCGKSA-N
XLogP2.74
TPSA66.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopropyl-N-ethyl-2-[(4R)-4-methyl-2,5-dioxo-3-phenylimidazolidin-1-yl]acetamide
CID 39537413
2-(4-methyl-2,5-dioxo-3-phenylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 46698957
1-[2-(2-methoxyphenyl)-2-oxoethyl]-4,4-dimethylpiperidine-2,6-dione
CID 62933610
2-[3-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-phenylacetamide
CID 46809674
(5S)-3-[[(4S)-4-hydroxy-5,8-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-5-methyl-1-phenylimidazolidine-2,4-dione
CID 51725101
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
3-[2-(3,4-dimethylphenyl)-2-oxoethyl]-1-(4-fluorophenyl)-5-methylimidazolidine-2,4-dione
CID 17407367
5-methyl-3-[2-oxo-2-[5-(pyrrolidine-1-carbonyl)-1H-pyrrol-3-yl]ethyl]-1-phenylimidazolidine-2,4-dione
CID 42933668
N-benzyl-2-[(4S)-3-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51608700
N-(furan-2-ylmethyl)-2-[(4S)-4-methyl-2,5-dioxo-3-phenylimidazolidin-1-yl]acetamide
CID 26075366
3-[2-(2-methoxyphenyl)-2-oxoethyl]-1,3-diazaspiro[4.5]decane-2,4-dione
CID 7609851
1-[2-(2-methoxyphenyl)-2-oxoethyl]-6-methylpyridin-2-one
CID 62024011

Frequently Asked Questions

What is the IUPAC name of (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione?
The IUPAC name of (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione (CID 39026900) is (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione.
What is the SMILES notation for (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione?
The canonical SMILES for (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione is COc1ccccc1C(=O)CN1C(=O)[C@H](C)N(c2ccccc2)C1=O.
What is the InChIKey of (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione?
The InChIKey is PZEYLBJHHVQJNH-ZDUSSCGKSA-N. The full InChI is InChI=1S/C19H18N2O4/c1-13-18(23)20(19(24)21(13)14-8-4-3-5-9-14)12-16(22)15-10-6-7-11-17(15)25-2/h3-11,13H,12H2,1-2H3/t13-/m0/s1.
What are the key properties of (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione?
(5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione has a molecular weight of 338.36 g/mol, XLogP of 2.74, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-3-[2-(2-methoxyphenyl)-2-oxoethyl]-5-methyl-1-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 39026900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).