5-pentadecylimidazolidine-2,4-dione

C18H34N2O2 — CID 19009290

IUPAC5-pentadecylimidazolidine-2,4-dione
SMILESCCCCCCCCCCCCCCCC1NC(=O)NC1=O
InChIInChI=1S/C18H34N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(21)20-18(22)19-16/h16H,2-15H2,1H3,(H2,19,20,21,22)
InChIKeyWJZUBEZVDWLBFE-UHFFFAOYSA-N
MW310.48 g/mol
LogP4.68
Rot. Bonds14

About 5-pentadecylimidazolidine-2,4-dione

5-pentadecylimidazolidine-2,4-dione (PubChem CID 19009290) has the molecular formula C18H34N2O2 and a molecular weight of 310.48 g/mol. Its IUPAC name is 5-pentadecylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-pentadecylimidazolidine-2,4-dione
PubChem CID19009290
Molecular FormulaC18H34N2O2
Molecular Weight310.48 g/mol
Exact Mass310.26
IUPAC Name5-pentadecylimidazolidine-2,4-dione
SMILESCCCCCCCCCCCCCCCC1NC(=O)NC1=O
InChIInChI=1S/C18H34N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(21)20-18(22)19-16/h16H,2-15H2,1H3,(H2,19,20,21,22)
InChIKeyWJZUBEZVDWLBFE-UHFFFAOYSA-N
XLogP4.68
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.48
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-pentadecylimidazolidine-2,4-dione?
The IUPAC name of 5-pentadecylimidazolidine-2,4-dione (CID 19009290) is 5-pentadecylimidazolidine-2,4-dione.
What is the SMILES notation for 5-pentadecylimidazolidine-2,4-dione?
The canonical SMILES for 5-pentadecylimidazolidine-2,4-dione is CCCCCCCCCCCCCCCC1NC(=O)NC1=O.
What is the InChIKey of 5-pentadecylimidazolidine-2,4-dione?
The InChIKey is WJZUBEZVDWLBFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(21)20-18(22)19-16/h16H,2-15H2,1H3,(H2,19,20,21,22).
What are the key properties of 5-pentadecylimidazolidine-2,4-dione?
5-pentadecylimidazolidine-2,4-dione has a molecular weight of 310.48 g/mol, XLogP of 4.68, 14 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pentadecylimidazolidine-2,4-dione is sourced from PubChem (CID 19009290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).