3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione

C11H19N3O2 — CID 43428593

IUPAC3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(C2CCCC2CN)C1=O
InChIInChI=1S/C11H19N3O2/c1-11(2)9(15)14(10(16)13-11)8-5-3-4-7(8)6-12/h7-8H,3-6,12H2,1-2H3,(H,13,16)
InChIKeyGFMKKZRHOXCFMQ-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.44
Rot. Bonds2

About 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione

3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione (PubChem CID 43428593) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione
PubChem CID43428593
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC Name3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione
SMILESCC1(C)NC(=O)N(C2CCCC2CN)C1=O
InChIInChI=1S/C11H19N3O2/c1-11(2)9(15)14(10(16)13-11)8-5-3-4-7(8)6-12/h7-8H,3-6,12H2,1-2H3,(H,13,16)
InChIKeyGFMKKZRHOXCFMQ-UHFFFAOYSA-N
XLogP0.44
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.44
H-Bond Donors ≤ 52
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 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione?
The IUPAC name of 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione (CID 43428593) is 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione?
The canonical SMILES for 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione is CC1(C)NC(=O)N(C2CCCC2CN)C1=O.
What is the InChIKey of 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione?
The InChIKey is GFMKKZRHOXCFMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c1-11(2)9(15)14(10(16)13-11)8-5-3-4-7(8)6-12/h7-8H,3-6,12H2,1-2H3,(H,13,16).
What are the key properties of 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione?
3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione has a molecular weight of 225.29 g/mol, XLogP of 0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(aminomethyl)cyclopentyl]-5,5-dimethylimidazolidine-2,4-dione is sourced from PubChem (CID 43428593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).