Basic information
- Standard SMILES
COc1c(NC2CCC3(CC2)OCC(C)(C)CO3)ccnc1C- InChIKey
WTRUNZPBDFCFFL-UHFFFAOYSA-N- Molecular formula
- C18H28N2O3
- Average molar mass
- 320.4 g/mol
Names & identifiers
- Preferred name
- 4-(3,3-Dimethyl-1,5-dioxaspiro[5.5]undec-9-ylamino)-3-methoxy-2-methylpyridine
- IUPAC
- N-(3,3-dimethyl-1,5-dioxaspiro[5.5]undecan-9-yl)-3-methoxy-2-methylpyridin-4-amine
Names & synonyms
SCHEMBL9034262WTRUNZPBDFCFFL-UHFFFAOYSA-N4-(3,3-Dimethyl-1,5-dioxaspiro[5.5]undec-9-ylamino)-3-methoxy-2-methylpyridine
Database identifiers
- PubChem CID
- 19693990
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 382
Related reactions
1 records
Linked notes
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