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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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).