5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione

C14H24N2O3 — CID 47395695

IUPAC5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione
SMILESCCC1(CC)NC(=O)N(CC2(O)CCCCC2)C1=O
InChIInChI=1S/C14H24N2O3/c1-3-14(4-2)11(17)16(12(18)15-14)10-13(19)8-6-5-7-9-13/h19H,3-10H2,1-2H3,(H,15,18)
InChIKeyJBLQHLTWFILTAE-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.79
Rot. Bonds4

About 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione

5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione (PubChem CID 47395695) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione
PubChem CID47395695
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione
SMILESCCC1(CC)NC(=O)N(CC2(O)CCCCC2)C1=O
InChIInChI=1S/C14H24N2O3/c1-3-14(4-2)11(17)16(12(18)15-14)10-13(19)8-6-5-7-9-13/h19H,3-10H2,1-2H3,(H,15,18)
InChIKeyJBLQHLTWFILTAE-UHFFFAOYSA-N
XLogP1.79
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione?
The IUPAC name of 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione (CID 47395695) is 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione is CCC1(CC)NC(=O)N(CC2(O)CCCCC2)C1=O.
What is the InChIKey of 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione?
The InChIKey is JBLQHLTWFILTAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-3-14(4-2)11(17)16(12(18)15-14)10-13(19)8-6-5-7-9-13/h19H,3-10H2,1-2H3,(H,15,18).
What are the key properties of 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione?
5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione has a molecular weight of 268.36 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diethyl-3-[(1-hydroxycyclohexyl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 47395695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).