Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(CCNc2cnc(C(N)=O)cn2)CC1- InChIKey
ICTGFNSVOOQLIO-UHFFFAOYSA-N- Molecular formula
- C17H27N5O3
- Average molar mass
- 349.4 g/mol
Names & identifiers
- Preferred name
- tert-Butyl 4-[2-(5-carbamoylpyrazin-2-ylamino)ethyl]piperidine-1-carboxylate
- IUPAC
- tert-butyl 4-[2-[(5-carbamoylpyrazin-2-yl)amino]ethyl]piperidine-1-carboxylate
Names & synonyms
SCHEMBL15051411ICTGFNSVOOQLIO-UHFFFAOYSA-Ntert-Butyl 4-[2-(5-carbamoylpyrazin-2-ylamino)ethyl]piperidine-1-carboxylate
Database identifiers
- PubChem CID
- 89645650
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 458
Related reactions
1 records
Compound notes
Loading…