5-cyclohexylimidazolidine-2,4-dione

C9H14N2O2 — CID 3870843

IUPAC5-cyclohexylimidazolidine-2,4-dione
SMILESO=C1NC(=O)C(C2CCCCC2)N1
InChIInChI=1S/C9H14N2O2/c12-8-7(10-9(13)11-8)6-4-2-1-3-5-6/h6-7H,1-5H2,(H2,10,11,12,13)
InChIKeyXMFKECBJDYLFKU-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.77
Rot. Bonds1

About 5-cyclohexylimidazolidine-2,4-dione

5-cyclohexylimidazolidine-2,4-dione (PubChem CID 3870843) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is 5-cyclohexylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-cyclohexylimidazolidine-2,4-dione
PubChem CID3870843
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name5-cyclohexylimidazolidine-2,4-dione
SMILESO=C1NC(=O)C(C2CCCCC2)N1
InChIInChI=1S/C9H14N2O2/c12-8-7(10-9(13)11-8)6-4-2-1-3-5-6/h6-7H,1-5H2,(H2,10,11,12,13)
InChIKeyXMFKECBJDYLFKU-UHFFFAOYSA-N
XLogP0.77
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

CID 12799
CID 12799
CID 13423
CID 13423
CID 12816
CID 12816
CID 100892
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CID 451207
CID 451207
CID 120427
CID 120427
CID 4520677
CID 4520677
CID 700302
CID 700302
CID 700303
CID 700303
CID 4875698
CID 4875698
CID 16293462
CID 16293462
CID 2998058
CID 2998058

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexylimidazolidine-2,4-dione?
The IUPAC name of 5-cyclohexylimidazolidine-2,4-dione (CID 3870843) is 5-cyclohexylimidazolidine-2,4-dione.
What is the SMILES notation for 5-cyclohexylimidazolidine-2,4-dione?
The canonical SMILES for 5-cyclohexylimidazolidine-2,4-dione is O=C1NC(=O)C(C2CCCCC2)N1.
What is the InChIKey of 5-cyclohexylimidazolidine-2,4-dione?
The InChIKey is XMFKECBJDYLFKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c12-8-7(10-9(13)11-8)6-4-2-1-3-5-6/h6-7H,1-5H2,(H2,10,11,12,13).
What are the key properties of 5-cyclohexylimidazolidine-2,4-dione?
5-cyclohexylimidazolidine-2,4-dione has a molecular weight of 182.22 g/mol, XLogP of 0.77, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexylimidazolidine-2,4-dione is sourced from PubChem (CID 3870843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).