4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide

C9H15N3O3 — CID 134907856

IUPAC4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide
SMILESCCC1(C(=O)NC(C)C)NC(=O)NC1=O
InChIInChI=1S/C9H15N3O3/c1-4-9(6(13)10-5(2)3)7(14)11-8(15)12-9/h5H,4H2,1-3H3,(H,10,13)(H2,11,12,14,15)
InChIKeyAFHCJSJYOMEWPU-UHFFFAOYSA-N
MW213.24 g/mol
LogP-0.50
Rot. Bonds3

About 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide

4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide (PubChem CID 134907856) has the molecular formula C9H15N3O3 and a molecular weight of 213.24 g/mol. Its IUPAC name is 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide.

Molecular Properties

Compound Name4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide
PubChem CID134907856
Molecular FormulaC9H15N3O3
Molecular Weight213.24 g/mol
Exact Mass213.11
IUPAC Name4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide
SMILESCCC1(C(=O)NC(C)C)NC(=O)NC1=O
InChIInChI=1S/C9H15N3O3/c1-4-9(6(13)10-5(2)3)7(14)11-8(15)12-9/h5H,4H2,1-3H3,(H,10,13)(H2,11,12,14,15)
InChIKeyAFHCJSJYOMEWPU-UHFFFAOYSA-N
XLogP-0.50
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 5-0.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

CID 103033
CID 103033
CID 253217
CID 253217
CID 36690602
CID 36690602
CID 853633
CID 853633
CID 853634
CID 853634
CID 3088069
CID 3088069
CID 72716279
CID 72716279
CID 18442718
CID 18442718
CID 53425842
CID 53425842
CID 335477
CID 335477
CID 71873198
CID 71873198
CID 132398441
CID 132398441

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide?
The IUPAC name of 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide (CID 134907856) is 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide.
What is the SMILES notation for 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide?
The canonical SMILES for 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide is CCC1(C(=O)NC(C)C)NC(=O)NC1=O.
What is the InChIKey of 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide?
The InChIKey is AFHCJSJYOMEWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3/c1-4-9(6(13)10-5(2)3)7(14)11-8(15)12-9/h5H,4H2,1-3H3,(H,10,13)(H2,11,12,14,15).
What are the key properties of 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide?
4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide has a molecular weight of 213.24 g/mol, XLogP of -0.50, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,5-dioxo-N-propan-2-ylimidazolidine-4-carboxamide is sourced from PubChem (CID 134907856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).