2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide

C24H33N3O3 — CID 51565159

IUPAC2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide
SMILESO=C1N[C@H](Cc2ccccc2)C(=O)N1CC(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C24H33N3O3/c28-22(27(19-12-6-2-7-13-19)20-14-8-3-9-15-20)17-26-23(29)21(25-24(26)30)16-18-10-4-1-5-11-18/h1,4-5,10-11,19-21H,2-3,6-9,12-17H2,(H,25,30)/t21-/m1/s1
InChIKeyYAOWTNYCPATVHF-OAQYLSRUSA-N
MW411.55 g/mol
LogP3.64
Rot. Bonds6

About 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide

2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide (PubChem CID 51565159) has the molecular formula C24H33N3O3 and a molecular weight of 411.55 g/mol. Its IUPAC name is 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide.

Molecular Properties

Compound Name2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide
PubChem CID51565159
Molecular FormulaC24H33N3O3
Molecular Weight411.55 g/mol
Exact Mass411.25
IUPAC Name2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide
SMILESO=C1N[C@H](Cc2ccccc2)C(=O)N1CC(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C24H33N3O3/c28-22(27(19-12-6-2-7-13-19)20-14-8-3-9-15-20)17-26-23(29)21(25-24(26)30)16-18-10-4-1-5-11-18/h1,4-5,10-11,19-21H,2-3,6-9,12-17H2,(H,25,30)/t21-/m1/s1
InChIKeyYAOWTNYCPATVHF-OAQYLSRUSA-N
XLogP3.64
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.55
LogP ≤ 53.64
H-Bond Donors ≤ 51
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 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide?
The IUPAC name of 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide (CID 51565159) is 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide.
What is the SMILES notation for 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide?
The canonical SMILES for 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide is O=C1N[C@H](Cc2ccccc2)C(=O)N1CC(=O)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide?
The InChIKey is YAOWTNYCPATVHF-OAQYLSRUSA-N. The full InChI is InChI=1S/C24H33N3O3/c28-22(27(19-12-6-2-7-13-19)20-14-8-3-9-15-20)17-26-23(29)21(25-24(26)30)16-18-10-4-1-5-11-18/h1,4-5,10-11,19-21H,2-3,6-9,12-17H2,(H,25,30)/t21-/m1/s1.
What are the key properties of 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide?
2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide has a molecular weight of 411.55 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-4-benzyl-2,5-dioxoimidazolidin-1-yl]-N,N-dicyclohexylacetamide is sourced from PubChem (CID 51565159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).