Basic information
- Standard SMILES
COC(=O)c1c(C)cc(=O)n(N)c1C- InChIKey
RWQAKINUHLJEGJ-UHFFFAOYSA-N- Molecular formula
- C9H12N2O3
- Average molar mass
- 196.2 g/mol
Names & identifiers
- Preferred name
- 1-Amino-2,4-dimethyl-6-oxo-1,6-dihydro-pyridine-3-carboxylic acid methyl ester
- IUPAC
- methyl 1-amino-2,4-dimethyl-6-oxopyridine-3-carboxylate
Names & synonyms
1-amino-2,4-dimethyl-6-oxo-1,6-dihydro-pyridine-3-carboxylic acid methyl esterSCHEMBL1977698RWQAKINUHLJEGJ-UHFFFAOYSA-N1310923-47-7DB-354371
Database identifiers
- PubChem CID
- 58307451
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 355
Related reactions
3 records
Compound notes
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