2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide

C18H22ClN3O3 — CID 4589964

IUPAC2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide
SMILESCC1(c2ccc(Cl)cc2)NC(=O)N(CC(=O)NC2CCCCC2)C1=O
InChIInChI=1S/C18H22ClN3O3/c1-18(12-7-9-13(19)10-8-12)16(24)22(17(25)21-18)11-15(23)20-14-5-3-2-4-6-14/h7-10,14H,2-6,11H2,1H3,(H,20,23)(H,21,25)
InChIKeyQKAUCZLTXFNMRO-UHFFFAOYSA-N
MW363.85 g/mol
LogP2.56
Rot. Bonds4

About 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide

2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide (PubChem CID 4589964) has the molecular formula C18H22ClN3O3 and a molecular weight of 363.85 g/mol. Its IUPAC name is 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide
PubChem CID4589964
Molecular FormulaC18H22ClN3O3
Molecular Weight363.85 g/mol
Exact Mass363.13
IUPAC Name2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide
SMILESCC1(c2ccc(Cl)cc2)NC(=O)N(CC(=O)NC2CCCCC2)C1=O
InChIInChI=1S/C18H22ClN3O3/c1-18(12-7-9-13(19)10-8-12)16(24)22(17(25)21-18)11-15(23)20-14-5-3-2-4-6-14/h7-10,14H,2-6,11H2,1H3,(H,20,23)(H,21,25)
InChIKeyQKAUCZLTXFNMRO-UHFFFAOYSA-N
XLogP2.56
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.85
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

D-phenylalanyl-N-(3-chlorobenzyl)-L-prolinamide
CID 25011732
2,4-Imidazolidinedione, 5-(p-chlorophenyl)-
CID 97124
2-(2,5-Dioxo-4,4-diphenylimidazolidin-1-yl)acetamide
CID 2107999
(5S)-3-Benzyl-5-ethyl-5-phenylimidazolidine-2,4-dione
CID 40633600
3-Methyl-5,5-diphenylimidazolidine-2,4-dione
CID 77899
(2~{s})-~{n}-[[2-(Aminomethyl)-5-Chloranyl-Phenyl]methyl]-1-[(2~{r})-2-Azanyl-3-Cyclohexyl-Propanoyl]pyrrolidine-2-Carboxamide
CID 129012068
m-Chlorobenzylamide, 2
CID 44237081
3-Hexyl-5,5-diphenylimidazolidine-2,4-dione
CID 24860362
4-Pyrimidinecarboxamide, 1,2,3,6-tetrahydro-5-((4-chlorobenzoyl)amino)-N-cyclohexyl-2,6-dioxo-
CID 361707
5-(4-Chlorophenyl)-5-methylimidazolidine-2,4-dione
CID 134587
5-(3-Chlorophenyl)-5-methylimidazolidine-2,4-dione
CID 243329
m-Chlorobenzylamide, 7
CID 44237086

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide?
The IUPAC name of 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide (CID 4589964) is 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide.
What is the SMILES notation for 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide?
The canonical SMILES for 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide is CC1(c2ccc(Cl)cc2)NC(=O)N(CC(=O)NC2CCCCC2)C1=O.
What is the InChIKey of 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide?
The InChIKey is QKAUCZLTXFNMRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22ClN3O3/c1-18(12-7-9-13(19)10-8-12)16(24)22(17(25)21-18)11-15(23)20-14-5-3-2-4-6-14/h7-10,14H,2-6,11H2,1H3,(H,20,23)(H,21,25).
What are the key properties of 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide?
2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide has a molecular weight of 363.85 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-cyclohexylacetamide is sourced from PubChem (CID 4589964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).