Basic information
- CAS
64038-09-1- Standard SMILES
CCC1(c2ccc(N)cc2)C(=O)NC(=O)N(C)C1=O- InChIKey
HJQDNWSIHPKTLV-UHFFFAOYSA-N- Molecular formula
- C13H15N3O3
- Average molar mass
- 261.28 g/mol
- Monoisotopic mass
- 261.11134135
Names & identifiers
- Preferred name
- 5-(p-Aminophenyl)-5-ethyl-1-methylbarbituric acid
- IUPAC
- 5-(4-aminophenyl)-5-ethyl-1-methyl-1,3-diazinane-2,4,6-trione
Names & synonyms
5-(p-Aminophenyl)-5-ethyl-1-methylbarbituric acid64038-09-10WPF5Z4IJ9RefChem:10725722,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(4-aminophenyl)-5-ethyl-1-methyl-BARBITURIC ACID, 5-(p-AMINOPHENYL)-5-ETHYL-1-METHYL-UNII-0WPF5Z4IJ9DTXSID80982057Q272373105-(4-Aminophenyl)-5-ethyl-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(4-AMINOPHENYL)-5-ETHYL-1-METHYL
Database identifiers
- CAS
64038-09-1- PubChem CID
- 46486
- DTXSID
DTXSID80982057- UNII
- 0WPF5Z4IJ9
- Nikkaji
- J93.472K
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 92.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 415
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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