5-(4,4-dimethylpentyl)imidazolidine-2,4-dione

C10H18N2O2 — CID 20609400

IUPAC5-(4,4-dimethylpentyl)imidazolidine-2,4-dione
SMILESCC(C)(C)CCCC1NC(=O)NC1=O
InChIInChI=1S/C10H18N2O2/c1-10(2,3)6-4-5-7-8(13)12-9(14)11-7/h7H,4-6H2,1-3H3,(H2,11,12,13,14)
InChIKeyNWHVPDBPMUCCIF-UHFFFAOYSA-N
MW198.27 g/mol
LogP1.41
Rot. Bonds3

About 5-(4,4-dimethylpentyl)imidazolidine-2,4-dione

5-(4,4-dimethylpentyl)imidazolidine-2,4-dione (PubChem CID 20609400) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 5-(4,4-dimethylpentyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(4,4-dimethylpentyl)imidazolidine-2,4-dione
PubChem CID20609400
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name5-(4,4-dimethylpentyl)imidazolidine-2,4-dione
SMILESCC(C)(C)CCCC1NC(=O)NC1=O
InChIInChI=1S/C10H18N2O2/c1-10(2,3)6-4-5-7-8(13)12-9(14)11-7/h7H,4-6H2,1-3H3,(H2,11,12,13,14)
InChIKeyNWHVPDBPMUCCIF-UHFFFAOYSA-N
XLogP1.41
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-(4,4-dimethylpentyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(4,4-dimethylpentyl)imidazolidine-2,4-dione (CID 20609400) is 5-(4,4-dimethylpentyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(4,4-dimethylpentyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(4,4-dimethylpentyl)imidazolidine-2,4-dione is CC(C)(C)CCCC1NC(=O)NC1=O.
What is the InChIKey of 5-(4,4-dimethylpentyl)imidazolidine-2,4-dione?
The InChIKey is NWHVPDBPMUCCIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-10(2,3)6-4-5-7-8(13)12-9(14)11-7/h7H,4-6H2,1-3H3,(H2,11,12,13,14).
What are the key properties of 5-(4,4-dimethylpentyl)imidazolidine-2,4-dione?
5-(4,4-dimethylpentyl)imidazolidine-2,4-dione has a molecular weight of 198.27 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,4-dimethylpentyl)imidazolidine-2,4-dione is sourced from PubChem (CID 20609400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).