5-Bromo-3-(2-(pyridin-2-yl)pyrrolidin-1-yl)pyrazin-2-amine
Basic information
- CAS
893612-27-6- Standard SMILES
Nc1ncc(Br)nc1N1CCCC1c1ccccn1- InChIKey
JQCDKLCWAMRVAS-UHFFFAOYSA-N- Molecular formula
- C13H14BrN5
- Average molar mass
- 320.19 g/mol
- Monoisotopic mass
- 319.04326
Names & identifiers
- Preferred name
- 5-Bromo-3-(2-(pyridin-2-yl)pyrrolidin-1-yl)pyrazin-2-amine
- IUPAC
- 5-bromo-3-(2-pyridin-2-ylpyrrolidin-1-yl)pyrazin-2-amine
- English name
- 5-Bromo-3-(2-pyridin-2-yl-pyrrolidin-1-yl)-pyrazin-2-ylamine
- Molecular formula
- C13H14BrN5
- Molecular weight
- 320.19
Names & synonyms
893612-27-65-Bromo-3-(2-pyridin-2-yl-pyrrolidin-1-yl)-pyrazin-2-ylamine5-Bromo-3-(2-(pyridin-2-yl)pyrrolidin-1-yl)pyrazin-2-amine5-Bromo-3-[2-(pyridin-2-yl)pyrrolidin-1-yl]pyrazin-2-amineMFCD080561775-bromo-3-(2-pyridin-2-ylpyrrolidin-1-yl)pyrazin-2-amineDTXSID30587511AKOS005257010DB-0783945-bromo-3-[2-(2-pyridyl)pyrrolidin-1-yl]pyrazin-2-amine2-Pyrazinamine, 5-bromo-3-[2-(2-pyridinyl)-1-pyrrolidinyl]-
Database identifiers
- CAS
893612-27-6- PubChem CID
- 16740451
- DTXSID
DTXSID30587511
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 67.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 303
Physicochemical properties
- Boiling point
- 501.8 · 501.8±50.0 °C(Predicted)
- Density
- 1.552 · 1.552±0.06 g/cm3(Predicted)
- pka
- 5.09 · 5.09±0.19(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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