Benzamide, 5-amino-N-butyl-4-chloro-2-(2-propynyloxy)-
Basic information
- CAS
30533-80-3- Standard SMILES
C#CCOc1cc(Cl)c(N)cc1C(=O)NCCCC- InChIKey
PEHDKEOBNLOTTE-UHFFFAOYSA-N- Molecular formula
- C14H17ClN2O2
- Average molar mass
- 280.75 g/mol
- Monoisotopic mass
- 280.0978555
Names & identifiers
- Preferred name
- Benzamide, 5-amino-N-butyl-4-chloro-2-(2-propynyloxy)-
- IUPAC
- 5-amino-N-butyl-4-chloro-2-prop-2-ynoxybenzamide
- English name
- 5-Amino-N-butyl-4-chloro-2-(2-propynyloxy)benzamide
- Molecular formula
- C14H17ClN2O2
- Molecular weight
- 280.75
Names & synonyms
30533-80-3BRN 29442705-Amino-N-butyl-4-chloro-2-(2-propynyloxy)benzamideBENZAMIDE, 5-AMINO-N-BUTYL-4-CHLORO-2-(2-PROPYNYLOXY)-DTXSID30184600RefChem:321853DTXCID301070915-Amino-N-butyl-4-chloro-2-[(prop-2-yn-1-yl)oxy]benzamideBenzamide, 5-amino-N-butyl-4-chloro-2-(2-propyn-1-yloxy)-
Database identifiers
- CAS
30533-80-3- PubChem CID
- 35371
- DTXSID
DTXSID30184600- Nikkaji
- J68.032J
Properties
Computed structural properties
- XLogP
- 3.2
- 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
- 340
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Compound notes
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