5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane

C122H156FN15O24 — CID 159468684

About 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane

5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane (PubChem CID 159468684) has the molecular formula C122H156FN15O24 and a molecular weight of 2235.67 g/mol. Its IUPAC name is 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane.

Molecular Properties

• Compound Name: 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane
• PubChem CID: 159468684
• Molecular Formula: C122H156FN15O24
• Molecular Weight: 2235.67 g/mol
• Exact Mass: 2234.14
• IUPAC Name: 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane
• SMILES: C.C.C.C.C.C.CCCN1C(=O)N(CC(=O)c2cccnc2)C(=O)C(C)(C2=CCCCC2)C1=O.CCN1C(=O)N(CC(=O)c2cccnc2)C(=O)C(C)(C2=CCCCC2)C1=O.CN1C(=O)N(CC(=O)c2cccc(F)c2)C(=O)C(C)(C2CCCC2)C1=O.CN1C(=O)N(CC(=O)c2ccccc2)C(=O)C(C)(C2=CCCC2)C1=O.CN1C(=O)N(CC(=O)c2ccccc2)C(=O)C(C)(C2CCCC2)C1=O.CN1C(=O)N(CC(=O)c2cccnc2)C(=O)C(C)(C2CCCC2)C1=O
• InChI: InChI=1S/C21H25N3O4.C20H23N3O4.C19H21FN2O4.C19H22N2O4.C19H20N2O4.C18H21N3O4.6CH4/c1-3-12-23-18(26)21(2,16-9-5-4-6-10-16)19(27)24(20(23)28)14-17(25)15-8-7-11-22-13-15;1-3-22-17(25)20(2,15-9-5-4-6-10-15)18(26)23(19(22)27)13-16(24)14-8-7-11-21-12-14;1-19(13-7-3-4-8-13)16(24)21(2)18(26)22(17(19)25)11-15(23)12-6-5-9-14(20)10-12;2*1-19(14-10-6-7-11-14)16(23)20(2)18(25)21(17(19)24)12-15(22)13-8-4-3-5-9-13;1-18(13-7-3-4-8-13)15(23)20(2)17(25)21(16(18)24)11-14(22)12-6-5-9-19-10-12;;;;;;/h7-9,11,13H,3-6,10,12,14H2,1-2H3;7-9,11-12H,3-6,10,13H2,1-2H3;5-6,9-10,13H,3-4,7-8,11H2,1-2H3;3-5,8-9,14H,6-7,10-12H2,1-2H3;3-5,8-10H,6-7,11-12H2,1-2H3;5-6,9-10,13H,3-4,7-8,11H2,1-2H3;6*1H4
• InChIKey: LVNAYARGJFPACT-UHFFFAOYSA-N
• XLogP: 18.77
• TPSA: 487.23 Ų
• H-Bond Acceptors: 27
• Rotatable Bonds: 27
• Heavy Atoms: 162
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2235.67
LogP ≤ 5	18.77
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane?

The IUPAC name of 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane (CID 159468684) is 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane.

What is the SMILES notation for 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane?

The canonical SMILES for 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane is C.C.C.C.C.C.CCCN1C(=O)N(CC(=O)c2cccnc2)C(=O)C(C)(C2=CCCCC2)C1=O.CCN1C(=O)N(CC(=O)c2cccnc2)C(=O)C(C)(C2=CCCCC2)C1=O.CN1C(=O)N(CC(=O)c2cccc(F)c2)C(=O)C(C)(C2CCCC2)C1=O.CN1C(=O)N(CC(=O)c2ccccc2)C(=O)C(C)(C2=CCCC2)C1=O.CN1C(=O)N(CC(=O)c2ccccc2)C(=O)C(C)(C2CCCC2)C1=O.CN1C(=O)N(CC(=O)c2cccnc2)C(=O)C(C)(C2CCCC2)C1=O.

What is the InChIKey of 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane?

The InChIKey is LVNAYARGJFPACT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O4.C20H23N3O4.C19H21FN2O4.C19H22N2O4.C19H20N2O4.C18H21N3O4.6CH4/c1-3-12-23-18(26)21(2,16-9-5-4-6-10-16)19(27)24(20(23)28)14-17(25)15-8-7-11-22-13-15;1-3-22-17(25)20(2,15-9-5-4-6-10-15)18(26)23(19(22)27)13-16(24)14-8-7-11-21-12-14;1-19(13-7-3-4-8-13)16(24)21(2)18(26)22(17(19)25)11-15(23)12-6-5-9-14(20)10-12;2*1-19(14-10-6-7-11-14)16(23)20(2)18(25)21(17(19)24)12-15(22)13-8-4-3-5-9-13;1-18(13-7-3-4-8-13)15(23)20(2)17(25)21(16(18)24)11-14(22)12-6-5-9-19-10-12;;;;;;/h7-9,11,13H,3-6,10,12,14H2,1-2H3;7-9,11-12H,3-6,10,13H2,1-2H3;5-6,9-10,13H,3-4,7-8,11H2,1-2H3;3-5,8-9,14H,6-7,10-12H2,1-2H3;3-5,8-10H,6-7,11-12H2,1-2H3;5-6,9-10,13H,3-4,7-8,11H2,1-2H3;6*1H4.

What are the key properties of 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane?

5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane has a molecular weight of 2235.67 g/mol, XLogP of 18.77, 27 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(cyclohexen-1-yl)-1-ethyl-5-methyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-(cyclohexen-1-yl)-5-methyl-1-(2-oxo-2-pyridin-3-ylethyl)-3-propyl-1,3-diazinane-2,4,6-trione;5-(cyclopenten-1-yl)-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-(2-oxo-2-pyridin-3-ylethyl)-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1,5-dimethyl-3-phenacyl-1,3-diazinane-2,4,6-trione;5-cyclopentyl-1-[2-(3-fluorophenyl)-2-oxoethyl]-3,5-dimethyl-1,3-diazinane-2,4,6-trione;methane is sourced from PubChem (CID 159468684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).