Molecular properties
- Formula
- C14H18N2O3
- Molar mass
- 262.31 g·mol−1
- Exact mass
- 262.1317 Da
- 7
- PubChem CID
- 9034
Molecule record
5-hex-3-yn-2-yl-1-methyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
C14H18N2O3
262.31 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Alkene
Alkyne
Amide
Secondary amine
Tertiary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- (+-)-5-Allyl-1-methyl-5-(1-methyl-2-pentynyl)barbituric acid
- 151-83-7
- 18652-93-2
- 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-(1-methyl-2-pentynyl)-5-(2-propenyl)-
- 5-(hex-3-yn-2-yl)-1-methyl-5-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione
- 5-(hex-3-yn-2-yl)-6-hydroxy-3-methyl-5-(prop-2-en-1-yl)-2,3,4,5-tetrahydropyrimidine-2,4-dione
- 5-Allyl-1-methyl-5-(1-methyl-2-pentynyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
- 5-Allyl-1-methyl-5-(1-methyl-pent-2-ynyl)-pyrimidine-2,4,6-trione
Show all 24 synonyms
- 5-Allyl-5-(3-hexyn-2-yl)-1-methylbarbituric acid
- Brietal-Sodium
- CHEBI:102216
- DTXSID1023287
- E5B8ND5IPE
- METHOHEXITAL
- Methodrexitone
- Methohexital, Monosodium Salt
- Methohexitalum
- Methohexitone
- Metoesital
- Metohexital
- Natrium, Brevimytal
- RefChem:56531
- Sodium, Methohexital
- alpha-DL-1-Methyl-5-allyl-5-(1'-methylpentyn-2-yl)barbituric acid
Structure identifiers
- Canonical SMILES
- C=CCC1(C(C)C#CCC)C(=O)NC(=O)N(C)C1=O
- Isomeric SMILES
- CCC#CC(C)C1(C(=O)NC(=O)N(C1=O)C)CC=C
- InChI
- InChI=1S/C14H18N2O3/c1-5-7-8-10(3)14(9-6-2)11(17)15-13(19)16(4)12(14)18/h6,10H,2,5,9H2,1,3-4H3,(H,15,17,19)
- InChIKey
- NZXKDOXHBHYTKP-UHFFFAOYSA-N
- PubChem CID
- 9034
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 5-hex-3-yn-2-yl-1-methyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 5-hex-3-yn-2-yl-1-methyl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.