Basic information
- Standard SMILES
C#CCOCC1(C)COC2(CCCCC2)N1- InChIKey
HTNXXOANNYBZFP-UHFFFAOYSA-N- Molecular formula
- C13H21NO2
- Average molar mass
- 223.31 g/mol
Names & identifiers
- Preferred name
- 3-Methyl-3-prop-2-ynyloxymethyl-1-oxa-4-aza-spiro[4.5]decane
- IUPAC
- 3-methyl-3-(prop-2-ynoxymethyl)-1-oxa-4-azaspiro[4.5]decane
Names & synonyms
SCHEMBL534461HTNXXOANNYBZFP-UHFFFAOYSA-N3-methyl-3-prop-2-ynyloxymethyl-1-oxa-4-aza-spiro[4.5]decane3-Methyl-3prop-2-ynyloxymethyl-1-oxa-4-aza-spiro[4.5]decane
Database identifiers
- PubChem CID
- 59565408
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 288
Related reactions
5 records
Compound notes
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