1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione

C6H9N3O2 — CID 68571828

IUPAC1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione
SMILESNC=CCN1CC(=O)NC1=O
InChIInChI=1S/C6H9N3O2/c7-2-1-3-9-4-5(10)8-6(9)11/h1-2H,3-4,7H2,(H,8,10,11)
InChIKeyALJVMJBDNMPRLV-UHFFFAOYSA-N
MW155.16 g/mol
LogP-0.99
Rot. Bonds2

About 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione

1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione (PubChem CID 68571828) has the molecular formula C6H9N3O2 and a molecular weight of 155.16 g/mol. Its IUPAC name is 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione
PubChem CID68571828
Molecular FormulaC6H9N3O2
Molecular Weight155.16 g/mol
Exact Mass155.07
IUPAC Name1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione
SMILESNC=CCN1CC(=O)NC1=O
InChIInChI=1S/C6H9N3O2/c7-2-1-3-9-4-5(10)8-6(9)11/h1-2H,3-4,7H2,(H,8,10,11)
InChIKeyALJVMJBDNMPRLV-UHFFFAOYSA-N
XLogP-0.99
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione?
The IUPAC name of 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione (CID 68571828) is 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione?
The canonical SMILES for 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione is NC=CCN1CC(=O)NC1=O.
What is the InChIKey of 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione?
The InChIKey is ALJVMJBDNMPRLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O2/c7-2-1-3-9-4-5(10)8-6(9)11/h1-2H,3-4,7H2,(H,8,10,11).
What are the key properties of 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione?
1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione has a molecular weight of 155.16 g/mol, XLogP of -0.99, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminoprop-2-enyl)imidazolidine-2,4-dione is sourced from PubChem (CID 68571828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).