(5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione

C14H16N2O3 — CID 2598130

IUPAC(5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione
SMILESCC(=O)CN1C(=O)N[C@H](CCc2ccccc2)C1=O
InChIInChI=1S/C14H16N2O3/c1-10(17)9-16-13(18)12(15-14(16)19)8-7-11-5-3-2-4-6-11/h2-6,12H,7-9H2,1H3,(H,15,19)/t12-/m1/s1
InChIKeyDDDOONKBDZURBT-GFCCVEGCSA-N
MW260.29 g/mol
LogP1.13
Rot. Bonds5

About (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione

(5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione (PubChem CID 2598130) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione
PubChem CID2598130
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name(5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione
SMILESCC(=O)CN1C(=O)N[C@H](CCc2ccccc2)C1=O
InChIInChI=1S/C14H16N2O3/c1-10(17)9-16-13(18)12(15-14(16)19)8-7-11-5-3-2-4-6-11/h2-6,12H,7-9H2,1H3,(H,15,19)/t12-/m1/s1
InChIKeyDDDOONKBDZURBT-GFCCVEGCSA-N
XLogP1.13
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[(4S)-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-ethylacetamide
CID 2598023
(5R)-3-(2-oxo-2-pyrrolidin-1-ylethyl)-5-(2-phenylethyl)imidazolidine-2,4-dione
CID 2704050
(5S)-3-[2-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]-5-(2-phenylethyl)imidazolidine-2,4-dione
CID 25362720
2-[2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(4-ethylphenyl)acetamide
CID 17447614
3-[2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]propanamide
CID 47117412
(5R)-3-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-5-(2-phenylethyl)imidazolidine-2,4-dione
CID 8012893
N-(4-chlorophenyl)-2-[(4S)-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide
CID 2704027
N-(2-chlorophenyl)-2-[(4R)-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide
CID 2703995
N-(2-tert-butylphenyl)-2-[(4R)-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide
CID 2703909
2-[(4S)-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 2598211
2-[(4R)-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 7916979
3-[2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-hydroxypropanamide
CID 87094358

Frequently Asked Questions

What is the IUPAC name of (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione?
The IUPAC name of (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione (CID 2598130) is (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione?
The canonical SMILES for (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione is CC(=O)CN1C(=O)N[C@H](CCc2ccccc2)C1=O.
What is the InChIKey of (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione?
The InChIKey is DDDOONKBDZURBT-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-10(17)9-16-13(18)12(15-14(16)19)8-7-11-5-3-2-4-6-11/h2-6,12H,7-9H2,1H3,(H,15,19)/t12-/m1/s1.
What are the key properties of (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione?
(5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione has a molecular weight of 260.29 g/mol, XLogP of 1.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-3-(2-oxopropyl)-5-(2-phenylethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 2598130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).