2-[6-[(6-Bromohexyl)oxy]-1-hexynyl]-4-pyridinecarboxamide
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Basic information
- Standard SMILES
NC(=O)c1ccnc(C#CCCCCOCCCCCCBr)c1- InChIKey
GJNZVBSGFLSRLX-UHFFFAOYSA-N- Molecular formula
- C18H25BrN2O2
- Average molar mass
- 381.3 g/mol
Names & identifiers
- Preferred name
- 2-[6-[(6-Bromohexyl)oxy]-1-hexynyl]-4-pyridinecarboxamide
- IUPAC
- 2-[6-(6-bromohexoxy)hex-1-ynyl]pyridine-4-carboxamide
Names & synonyms
SCHEMBL10465952GJNZVBSGFLSRLX-UHFFFAOYSA-N2-[6-[(6-Bromohexyl)oxy]-1-hexynyl]-4-pyridinecarboxamide
Database identifiers
- PubChem CID
- 19854797
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 65.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 12
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 389
Related reactions
4 records
Compound notes
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