Basic information
- Standard SMILES
CCOC(=O)C(NC(C)(C)C)c1cccnc1- InChIKey
PUGWBRLXKFLGEL-UHFFFAOYSA-N- Molecular formula
- C13H20N2O2
- Average molar mass
- 236.31 g/mol
Names & identifiers
- Preferred name
- Tert-butylamino-pyridin-3-yl-acetic acid ethyl ester
- IUPAC
- ethyl 2-(tert-butylamino)-2-pyridin-3-ylacetate
Names & synonyms
SCHEMBL6644428PUGWBRLXKFLGEL-UHFFFAOYSA-Ntert-butylamino-pyridin-3-yl-acetic acid ethyl ester
Database identifiers
- PubChem CID
- 69850097
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 248
Related reactions
2 records
Compound notes
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