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

C11H13N3O2 — CID 69398064

IUPAC5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione
SMILESNCC(c1ccccc1)C1NC(=O)NC1=O
InChIInChI=1S/C11H13N3O2/c12-6-8(7-4-2-1-3-5-7)9-10(15)14-11(16)13-9/h1-5,8-9H,6,12H2,(H2,13,14,15,16)
InChIKeyYOWZYORYMOYOOE-UHFFFAOYSA-N
MW219.24 g/mol
LogP-0.06
Rot. Bonds3

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

5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione (PubChem CID 69398064) has the molecular formula C11H13N3O2 and a molecular weight of 219.24 g/mol. Its IUPAC name is 5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione
PubChem CID69398064
Molecular FormulaC11H13N3O2
Molecular Weight219.24 g/mol
Exact Mass219.10
IUPAC Name5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione
SMILESNCC(c1ccccc1)C1NC(=O)NC1=O
InChIInChI=1S/C11H13N3O2/c12-6-8(7-4-2-1-3-5-7)9-10(15)14-11(16)13-9/h1-5,8-9H,6,12H2,(H2,13,14,15,16)
InChIKeyYOWZYORYMOYOOE-UHFFFAOYSA-N
XLogP-0.06
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 5-0.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopropyl-2-phenylethanamine;hydrochloride
CID 57365234
2-cyclobutyl-2-phenylethanamine;hydrochloride
CID 155858547
(2R)-2-(4,4-dimethylcyclohexyl)-2-phenylethanamine
CID 121454644
2-phenyl-2-piperidin-4-ylethanamine;hydrochloride
CID 67691179
4-imino-5-(1-phenylethyl)imidazolidin-2-one
CID 138389193
5-[phenyl-(2,4,6-trioxo-1,3-diazinan-5-yl)methyl]-1,3-diazinane-2,4,6-trione
CID 2042273
5-phenyl-(411C)1,3-diazolidine-2,4-dione
CID 90678716
5-pentan-3-ylimidazolidine-2,4-dione
CID 11435187
3-(2-amino-1-phenylethyl)piperidin-4-ol
CID 68810626
4-(2-amino-1-phenylethyl)-3-methylpiperazine-2,6-dione
CID 66061881
(2S)-2-amino-N-(2,5-dioxoimidazolidin-4-yl)-3-phenylpropanamide
CID 66914825
2-(carbamoylamino)-2-phenylacetic acid;5-phenylimidazolidine-2,4-dione
CID 67842876

Frequently Asked Questions

What is the IUPAC name of 5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione (CID 69398064) is 5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione is NCC(c1ccccc1)C1NC(=O)NC1=O.
What is the InChIKey of 5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione?
The InChIKey is YOWZYORYMOYOOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O2/c12-6-8(7-4-2-1-3-5-7)9-10(15)14-11(16)13-9/h1-5,8-9H,6,12H2,(H2,13,14,15,16).
What are the key properties of 5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione?
5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione has a molecular weight of 219.24 g/mol, XLogP of -0.06, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-amino-1-phenylethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 69398064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).