Basic information
- Standard SMILES
CC(C)(C)OC(=O)NCCOCCNC(=O)c1cccnc1- InChIKey
WAQBXEYAXBRBLN-UHFFFAOYSA-N- Molecular formula
- C15H23N3O4
- Average molar mass
- 309.36 g/mol
Names & identifiers
- Preferred name
- Tert-butyl 2-(2-(nicotinamido)ethoxy)ethylcarbamate
- IUPAC
- tert-butyl N-[2-[2-(pyridine-3-carbonylamino)ethoxy]ethyl]carbamate
Names & synonyms
SCHEMBL6523383WAQBXEYAXBRBLN-UHFFFAOYSA-Ntert-butyl 2-(2-(nicotinamido)ethoxy)ethylcarbamate
Database identifiers
- PubChem CID
- 69811586
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 89.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 355
Related reactions
11 records
Compound notes
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