5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione

C13H16N2O2 — CID 150985688

IUPAC5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione
SMILESCCC1C(=O)NC(=O)N1C(C)c1ccccc1
InChIInChI=1S/C13H16N2O2/c1-3-11-12(16)14-13(17)15(11)9(2)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,14,16,17)
InChIKeyLRAOXIUUXITRTC-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.08
Rot. Bonds3

About 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione

5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione (PubChem CID 150985688) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione
PubChem CID150985688
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC Name5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione
SMILESCCC1C(=O)NC(=O)N1C(C)c1ccccc1
InChIInChI=1S/C13H16N2O2/c1-3-11-12(16)14-13(17)15(11)9(2)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,14,16,17)
InChIKeyLRAOXIUUXITRTC-UHFFFAOYSA-N
XLogP2.08
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3,6-diethyl-3-methyl-1-(1-phenylethyl)piperazine-2,5-dione
CID 64957642
6-ethyl-1-(1-phenylethyl)-3-propylpiperazine-2,5-dione
CID 64957677
6-ethyl-3,3-dimethyl-1-(1-phenylpropyl)piperazine-2,5-dione
CID 64968919
4-(2-amino-1-phenylpropyl)-3-ethylpiperazine-2,6-dione
CID 66068482
(3S,6S)-3,6-dibenzyl-1,4-bis[(1S)-1-phenylethyl]piperazine-2,5-dione
CID 11730822
1-[1-(4-bromophenyl)ethyl]-3,6-diethylpiperazine-2,5-dione
CID 64965367
6-ethyl-1-(3-phenylbutyl)piperazine-2,5-dione
CID 64970133
3-ethyl-4-(1-oxo-1-phenylpropan-2-yl)piperazine-2,6-dione
CID 66068748
(3R,4S)-3-ethyl-1-[(1S)-1-phenylethyl]-4-(phenylsulfanylmethyl)azetidin-2-one
CID 10914354
4-(2-amino-2-phenylacetyl)-3-ethylpiperazine-2,6-dione
CID 66069529
3-ethyl-4-(2-phenylpropylsulfonyl)piperazin-2-one
CID 80691437
(3S)-1-methyl-4-[(1S)-1-phenylethyl]-3-propyl-3H-1,4-benzodiazepine-2,5-dione
CID 10544857

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione (CID 150985688) is 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione is CCC1C(=O)NC(=O)N1C(C)c1ccccc1.
What is the InChIKey of 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione?
The InChIKey is LRAOXIUUXITRTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-3-11-12(16)14-13(17)15(11)9(2)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,14,16,17).
What are the key properties of 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione?
5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione has a molecular weight of 232.28 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-(1-phenylethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 150985688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).