Basic information
- Standard SMILES
CC(C)(C)OC(=O)NCCNC(=O)c1cccnc1- InChIKey
MXIBSZJSMIJMLT-UHFFFAOYSA-N- Molecular formula
- C13H19N3O3
- Average molar mass
- 265.31 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 2-(nicotinamido)ethylcarbamate
- IUPAC
- tert-butyl N-[2-(pyridine-3-carbonylamino)ethyl]carbamate
Names & synonyms
tert-butyl 2-(nicotinamido)ethylcarbamate752243-83-7SCHEMBL3402444MXIBSZJSMIJMLT-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 47453328
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 313
Related reactions
11 records
Compound notes
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