N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide

C18H23N3O3 — CID 140549487

IUPACN-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide
SMILESO=C(CC1CCCCC1)NN1C(=O)CN(Cc2ccccc2)C1=O
InChIInChI=1S/C18H23N3O3/c22-16(11-14-7-3-1-4-8-14)19-21-17(23)13-20(18(21)24)12-15-9-5-2-6-10-15/h2,5-6,9-10,14H,1,3-4,7-8,11-13H2,(H,19,22)
InChIKeyAEUZHTMSMAGFPX-UHFFFAOYSA-N
MW329.40 g/mol
LogP2.45
Rot. Bonds5

About N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide

N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide (PubChem CID 140549487) has the molecular formula C18H23N3O3 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide.

Molecular Properties

Compound NameN-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide
PubChem CID140549487
Molecular FormulaC18H23N3O3
Molecular Weight329.40 g/mol
Exact Mass329.17
IUPAC NameN-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide
SMILESO=C(CC1CCCCC1)NN1C(=O)CN(Cc2ccccc2)C1=O
InChIInChI=1S/C18H23N3O3/c22-16(11-14-7-3-1-4-8-14)19-21-17(23)13-20(18(21)24)12-15-9-5-2-6-10-15/h2,5-6,9-10,14H,1,3-4,7-8,11-13H2,(H,19,22)
InChIKeyAEUZHTMSMAGFPX-UHFFFAOYSA-N
XLogP2.45
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 52.45
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 N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide?
The IUPAC name of N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide (CID 140549487) is N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide.
What is the SMILES notation for N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide?
The canonical SMILES for N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide is O=C(CC1CCCCC1)NN1C(=O)CN(Cc2ccccc2)C1=O.
What is the InChIKey of N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide?
The InChIKey is AEUZHTMSMAGFPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O3/c22-16(11-14-7-3-1-4-8-14)19-21-17(23)13-20(18(21)24)12-15-9-5-2-6-10-15/h2,5-6,9-10,14H,1,3-4,7-8,11-13H2,(H,19,22).
What are the key properties of N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide?
N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide has a molecular weight of 329.40 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzyl-2,5-dioxoimidazolidin-1-yl)-2-cyclohexylacetamide is sourced from PubChem (CID 140549487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).