Basic information
- Standard SMILES
CC(C)(C)OC(=O)c1ccc(NC[C@@H](O)CO)nc1- InChIKey
XMYPOZDWUUNQGQ-SNVBAGLBSA-N- Molecular formula
- C13H20N2O4
- Average molar mass
- 268.31 g/mol
Names & identifiers
- Preferred name
- 3-(t-Butoxycarbonyl)-6-[(r)-propane-1,2-diol-3-yl]aminopyridine
- IUPAC
- tert-butyl 6-[[(2R)-2,3-dihydroxypropyl]amino]pyridine-3-carboxylate
Names & synonyms
SCHEMBL6097737XMYPOZDWUUNQGQ-SNVBAGLBSA-N3-(t-butoxycarbonyl)-6-[(r)-propane-1,2-diol-3-yl]aminopyridine3-(t-butoxycarbonyl)-6-[(r)propane-1,2-diol-3-yl]aminopyridine
Database identifiers
- PubChem CID
- 22977308
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 91.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 291
Related reactions
4 records
Compound notes
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