1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide

C18H25N3O3 — CID 68593758

IUPAC1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide
SMILESNC(=O)CC1CCCCC1.O=C1CN(Cc2ccccc2)C(=O)N1
InChIInChI=1S/C10H10N2O2.C8H15NO/c13-9-7-12(10(14)11-9)6-8-4-2-1-3-5-8;9-8(10)6-7-4-2-1-3-5-7/h1-5H,6-7H2,(H,11,13,14);7H,1-6H2,(H2,9,10)
InChIKeyHJPVJSBPWUCASI-UHFFFAOYSA-N
MW331.42 g/mol
LogP2.18
Rot. Bonds4

About 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide

1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide (PubChem CID 68593758) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide.

Molecular Properties

Compound Name1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide
PubChem CID68593758
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide
SMILESNC(=O)CC1CCCCC1.O=C1CN(Cc2ccccc2)C(=O)N1
InChIInChI=1S/C10H10N2O2.C8H15NO/c13-9-7-12(10(14)11-9)6-8-4-2-1-3-5-8;9-8(10)6-7-4-2-1-3-5-7/h1-5H,6-7H2,(H,11,13,14);7H,1-6H2,(H2,9,10)
InChIKeyHJPVJSBPWUCASI-UHFFFAOYSA-N
XLogP2.18
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 52.18
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 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide?
The IUPAC name of 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide (CID 68593758) is 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide.
What is the SMILES notation for 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide?
The canonical SMILES for 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide is NC(=O)CC1CCCCC1.O=C1CN(Cc2ccccc2)C(=O)N1.
What is the InChIKey of 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide?
The InChIKey is HJPVJSBPWUCASI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2.C8H15NO/c13-9-7-12(10(14)11-9)6-8-4-2-1-3-5-8;9-8(10)6-7-4-2-1-3-5-7/h1-5H,6-7H2,(H,11,13,14);7H,1-6H2,(H2,9,10).
What are the key properties of 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide?
1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide has a molecular weight of 331.42 g/mol, XLogP of 2.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzylimidazolidine-2,4-dione;2-cyclohexylacetamide is sourced from PubChem (CID 68593758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).