(5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione

C13H17N3O2 — CID 10613013

IUPAC(5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione
SMILESCN1C(=O)N(C)[C@](CCN)(c2ccccc2)C1=O
InChIInChI=1S/C13H17N3O2/c1-15-11(17)13(8-9-14,16(2)12(15)18)10-6-4-3-5-7-10/h3-7H,8-9,14H2,1-2H3/t13-/m1/s1
InChIKeyQXXJUOHIXSVYDE-CYBMUJFWSA-N
MW247.30 g/mol
LogP0.75
Rot. Bonds3

About (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione

(5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione (PubChem CID 10613013) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione
PubChem CID10613013
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name(5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione
SMILESCN1C(=O)N(C)[C@](CCN)(c2ccccc2)C1=O
InChIInChI=1S/C13H17N3O2/c1-15-11(17)13(8-9-14,16(2)12(15)18)10-6-4-3-5-7-10/h3-7H,8-9,14H2,1-2H3/t13-/m1/s1
InChIKeyQXXJUOHIXSVYDE-CYBMUJFWSA-N
XLogP0.75
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 50.75
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-[2-[(4R)-1,3-dimethyl-2,5-dioxo-4-phenylimidazolidin-4-yl]ethyl]isoindole-1,3-dione
CID 10785812
1,3-dimethyl-5-(4-methylphenyl)-5-phenylimidazolidine-2,4-dione
CID 71388254
(5S)-5-ethyl-1-methyl-5-phenylimidazolidine-2,4-dione
CID 45095321
1-methoxy-3-methyl-5,5-diphenyl-1,3-diazinane-2,4,6-trione
CID 161316865
5-[hydroxy(phenyl)methyl]-1,3-dimethyl-5-phenylimidazolidine-2,4-dione
CID 14493359
(5S)-5-(1,3-dioxo-1,3-diphenylpropan-2-yl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione;(5R)-5-(1,3-dioxo-1,3-diphenylpropan-2-yl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione
CID 139037842
2-[(4R)-1-methyl-2,5-dioxo-4-phenylimidazolidin-4-yl]ethylazanium chloride
CID 10612066
3-(2-aminoethyl)-1-(dimethylamino)-3-phenylindol-2-one
CID 28933
(1-methyl-2,5-dioxo-4-phenylimidazolidin-4-yl)methylazanide
CID 22960631
methyl 3-(4-chlorophenyl)-2-(1,3-dimethyl-2,5-dioxo-4-phenylimidazolidin-4-yl)-3-oxopropanoate
CID 102045214
5-ethyl-5-phenyl-1,3-bis(trimethylsilyl)imidazolidine-2,4-dione
CID 140848439
4,6-dimethyl-3a,6a-diphenyl-1,3-dihydroimidazo[4,5-d]imidazole-2,5-dione
CID 657701

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione?
The IUPAC name of (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione (CID 10613013) is (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione is CN1C(=O)N(C)[C@](CCN)(c2ccccc2)C1=O.
What is the InChIKey of (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione?
The InChIKey is QXXJUOHIXSVYDE-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-15-11(17)13(8-9-14,16(2)12(15)18)10-6-4-3-5-7-10/h3-7H,8-9,14H2,1-2H3/t13-/m1/s1.
What are the key properties of (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione?
(5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione has a molecular weight of 247.30 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(2-aminoethyl)-1,3-dimethyl-5-phenylimidazolidine-2,4-dione is sourced from PubChem (CID 10613013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).