Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCNC(CNc2cccnc2)C1- InChIKey
DFORWVLULIMNRS-UHFFFAOYSA-N- Molecular formula
- C15H24N4O2
- Average molar mass
- 292.38 g/mol
- Monoisotopic mass
- 292.18992602
Names & identifiers
- Preferred name
- Tert-butyl 3-((pyridin-3-ylamino)methyl)piperazine-1-carboxylate
- IUPAC
- tert-butyl 3-[(pyridin-3-ylamino)methyl]piperazine-1-carboxylate
Names & synonyms
SCHEMBL780721DFORWVLULIMNRS-UHFFFAOYSA-Ntert-butyl 3-((pyridin-3-ylamino)methyl)piperazine-1-carboxylate
Database identifiers
- PubChem CID
- 59671589
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 343
Related reactions
7 records
Linked notes
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