5-bromo-N-cyclopropylnicotinamide
Basic information
- CAS
385382-48-9- Standard SMILES
O=C(NC1CC1)c1cncc(Br)c1- InChIKey
SYKDJEARKMRQGE-UHFFFAOYSA-N- Molecular formula
- C9H9BrN2O
- Average molar mass
- 241.08 g/mol
- Monoisotopic mass
- 239.98983
Names & identifiers
- Preferred name
- 5-bromo-N-cyclopropylnicotinamide
- IUPAC
- 5-bromo-N-cyclopropylpyridine-3-carboxamide
- English name
- N-Cyclopropyl5-bromonicotinamide
- Molecular formula
- C9H9BrN2O
- Molecular weight
- 241.09
Names & synonyms
5-bromo-N-cyclopropylnicotinamide385382-48-9N-CYCLOPROPYL 5-BROMONICOTINAMIDE5-bromo-N-cyclopropylpyridine-3-carboxamideN-Cyclopropyl5-bromonicotinamideMFCD030176785-Bromo-N-cyclopropyl-nicotinamideChemDiv2_002365Cambridge id 6822856Oprea1_519825SCHEMBL5258490SCHEMBL31555021
Show more names
Lasmiditan Impurity 303-Pyridinecarboxamide, 5-bromo-N-cyclopropyl-
DTXSID40345402HMS1375L11AKOS001460522MB02562BS-28278ST038327SY3171025-Bromo-N-cyclopropyl-3-pyridinecarboxamide
Database identifiers
- CAS
385382-48-9- PubChem CID
- 604228
- DTXSID
DTXSID40345402
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 206
Physicochemical properties
- Boiling point
- 377.9 · 377.9±27.0 °C(Predicted)
- Density
- 1.62 · 1.62±0.1 g/cm3(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- pka
- 13.77 · 13.77±0.20(Predicted)
- form
- Solid
- color
- White to Off-White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses5-Bromo-N-cyclopropylnicotinamide can be used to prepare antibacterial drugs.
Suppliers
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Related reactions
1 records
Compound notes
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