N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide

C12H19N3O3 — CID 2109987

IUPACN-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCN1CC(=O)N(CC(=O)NC2CCCCC2)C1=O
InChIInChI=1S/C12H19N3O3/c1-14-8-11(17)15(12(14)18)7-10(16)13-9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,13,16)
InChIKeyDPKNNZSVSQSCKX-UHFFFAOYSA-N
MW253.30 g/mol
LogP0.33
Rot. Bonds3

About N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide

N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide (PubChem CID 2109987) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
PubChem CID2109987
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC NameN-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
SMILESCN1CC(=O)N(CC(=O)NC2CCCCC2)C1=O
InChIInChI=1S/C12H19N3O3/c1-14-8-11(17)15(12(14)18)7-10(16)13-9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,13,16)
InChIKeyDPKNNZSVSQSCKX-UHFFFAOYSA-N
XLogP0.33
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.33
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-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide (CID 2109987) is N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide is CN1CC(=O)N(CC(=O)NC2CCCCC2)C1=O.
What is the InChIKey of N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
The InChIKey is DPKNNZSVSQSCKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-14-8-11(17)15(12(14)18)7-10(16)13-9-5-3-2-4-6-9/h9H,2-8H2,1H3,(H,13,16).
What are the key properties of N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide?
N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide has a molecular weight of 253.30 g/mol, XLogP of 0.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 2109987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).