Basic information
- Standard SMILES
CC(C)C1c2nc[nH]c2CCN1C(=O)O[C@H]1CCOC1- InChIKey
AMIPLQUGEQTRSM-NKUHCKNESA-N- Molecular formula
- C14H21N3O3
- Average molar mass
- 279.33 g/mol
- Monoisotopic mass
- 279.15829154
Names & identifiers
- Preferred name
- (3S)-tetrahydro-furan-3-yl 4-isopropyl-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carboxylate
- IUPAC
- [(3S)-oxolan-3-yl] 4-propan-2-yl-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxylate
Names & synonyms
SCHEMBL2345148SCHEMBL17704909AMIPLQUGEQTRSM-NKUHCKNESA-N(35)-tetrahydro-furan-3-yl 4-isopropyl-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carboxylate(3S)-tetrahydro-furan-3-yl 4-isopropyl-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carboxylate(3S)-tetrahydrofuran-3-yl 4-isopropyl-1,4,6,7-tetrahydro-5H-imidazo[4,5-c]pyridine-5-carboxylate
Database identifiers
- PubChem CID
- 67372017
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 67.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 364
Related reactions
3 records
Compound notes
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