N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide

C11H17N3O3 — CID 10900719

IUPACN-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide
SMILESCC1(C(=O)NC2CCCCC2)NC(=O)NC1=O
InChIInChI=1S/C11H17N3O3/c1-11(9(16)13-10(17)14-11)8(15)12-7-5-3-2-4-6-7/h7H,2-6H2,1H3,(H,12,15)(H2,13,14,16,17)
InChIKeyUJELRHGYXQGYPB-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.03
Rot. Bonds2

About N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide

N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide (PubChem CID 10900719) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide
PubChem CID10900719
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC NameN-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide
SMILESCC1(C(=O)NC2CCCCC2)NC(=O)NC1=O
InChIInChI=1S/C11H17N3O3/c1-11(9(16)13-10(17)14-11)8(15)12-7-5-3-2-4-6-7/h7H,2-6H2,1H3,(H,12,15)(H2,13,14,16,17)
InChIKeyUJELRHGYXQGYPB-UHFFFAOYSA-N
XLogP0.03
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide?
The IUPAC name of N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide (CID 10900719) is N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide is CC1(C(=O)NC2CCCCC2)NC(=O)NC1=O.
What is the InChIKey of N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide?
The InChIKey is UJELRHGYXQGYPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-11(9(16)13-10(17)14-11)8(15)12-7-5-3-2-4-6-7/h7H,2-6H2,1H3,(H,12,15)(H2,13,14,16,17).
What are the key properties of N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide?
N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide has a molecular weight of 239.27 g/mol, XLogP of 0.03, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-methyl-2,5-dioxoimidazolidine-4-carboxamide is sourced from PubChem (CID 10900719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).