Benzamide, 5-amino-N-isopentyl-2-(2-propynyloxy)-
Basic information
- CAS
30533-83-6- Standard SMILES
C#CCOc1ccc(N)cc1C(=O)NCCC(C)C- InChIKey
DBTWYVYZXAQYSL-UHFFFAOYSA-N- Molecular formula
- C15H20N2O2
- Average molar mass
- 260.33 g/mol
- Monoisotopic mass
- 260.15247789
Names & identifiers
- Preferred name
- Benzamide, 5-amino-N-isopentyl-2-(2-propynyloxy)-
- IUPAC
- 5-amino-N-(3-methylbutyl)-2-prop-2-ynoxybenzamide
- English name
- 5-Amino-N-isopentyl-2-(2-propynyloxy)benzamide
- Molecular formula
- C15H20N2O2
- Molecular weight
- 260.33
Names & synonyms
30533-83-65-Amino-N-isopentyl-2-(2-propynyloxy)benzamideBRN 2943260Benzamide, 5-amino-N-isopentyl-2-(2-propynyloxy)-Benzamide, 5-amino-N-(3-methylbutyl)-2-(2-propynyloxy)-DTXSID10184603RefChem:321856DTXCID101070945-Amino-N-(3-methylbutyl)-2-[(prop-2-yn-1-yl)oxy]benzamideBenzamide, 5-amino-N-(3-methylbutyl)-2-(2-propyn-1-yloxy)-
Database identifiers
- CAS
30533-83-6- PubChem CID
- 207704
- DTXSID
DTXSID10184603- Nikkaji
- J68.044C
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 332
Physicochemical properties
- Boiling point
- 429.2 · 429.2±45.0 °C(Predicted)
- Density
- 1.088 · 1.088±0.06 g/cm3(Predicted)
- pka
- 14.77 · 14.77±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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