5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione

C15H22N2O3 — CID 115948196

IUPAC5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione
SMILESCC1CCCC1N1C(=O)NC(=O)C(C2CCCC2)C1=O
InChIInChI=1S/C15H22N2O3/c1-9-5-4-8-11(9)17-14(19)12(10-6-2-3-7-10)13(18)16-15(17)20/h9-12H,2-8H2,1H3,(H,16,18,20)
InChIKeyCGLMXGLGZRBBIE-UHFFFAOYSA-N
MW278.35 g/mol
LogP2.06
Rot. Bonds2

About 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione

5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione (PubChem CID 115948196) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione.

Molecular Properties

Compound Name5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione
PubChem CID115948196
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione
SMILESCC1CCCC1N1C(=O)NC(=O)C(C2CCCC2)C1=O
InChIInChI=1S/C15H22N2O3/c1-9-5-4-8-11(9)17-14(19)12(10-6-2-3-7-10)13(18)16-15(17)20/h9-12H,2-8H2,1H3,(H,16,18,20)
InChIKeyCGLMXGLGZRBBIE-UHFFFAOYSA-N
XLogP2.06
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1,5-dicyclopentyl-1,3-diazinane-2,4,6-trione
CID 112598446
5-cyclopentyl-1-(4-methylcyclohexyl)-1,3-diazinane-2,4,6-trione
CID 104963571
5-cyclopentyl-1-(2,2-difluoroethyl)-1,3-diazinane-2,4,6-trione
CID 112601416
5-cyclopentyl-1-(3,3-dimethylbutan-2-yl)-1,3-diazinane-2,4,6-trione
CID 104830815
2-cyclopentyl-5-methyl-3-(2-methylcyclopentyl)imidazolidin-4-one
CID 83257817
5-cyclopentyl-1-(2-methyl-3-methylsulfanylpropyl)-1,3-diazinane-2,4,6-trione
CID 115948242
8-(2-methylcyclohexyl)-6,8-diazaspiro[3.5]nonane-5,7,9-trione
CID 112598608
3,6-diethyl-1-(2-methylcyclopentyl)piperazine-2,5-dione
CID 64970415
5-cyclopentyl-1-[2-(2-methoxyethoxy)ethyl]-1,3-diazinane-2,4,6-trione
CID 115947273
1-(2,4-dimethylcyclohexyl)-5-propyl-1,3-diazinane-2,4,6-trione
CID 115948158
2-cyclopentyl-3-(2-methylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83264147
3,6-dimethyl-1-(2-methylcyclopentyl)piperazine-2,5-dione
CID 64970393

Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione?
The IUPAC name of 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione (CID 115948196) is 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione.
What is the SMILES notation for 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione?
The canonical SMILES for 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione is CC1CCCC1N1C(=O)NC(=O)C(C2CCCC2)C1=O.
What is the InChIKey of 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione?
The InChIKey is CGLMXGLGZRBBIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-9-5-4-8-11(9)17-14(19)12(10-6-2-3-7-10)13(18)16-15(17)20/h9-12H,2-8H2,1H3,(H,16,18,20).
What are the key properties of 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione?
5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione has a molecular weight of 278.35 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-1-(2-methylcyclopentyl)-1,3-diazinane-2,4,6-trione is sourced from PubChem (CID 115948196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).