Basic information
- CAS
1119089-48-3- Standard SMILES
COc1cccc(-c2ncc(N)cc2Br)c1- InChIKey
WGVTZYQBILULGS-UHFFFAOYSA-N- Molecular formula
- C12H11BrN2O
- Average molar mass
- 279.13 g/mol
- Monoisotopic mass
- 278.00547507
Names & identifiers
- Preferred name
- 5-Bromo-6-(3-methoxyphenyl)pyridin-3-amine
- IUPAC
- 5-bromo-6-(3-methoxyphenyl)pyridin-3-amine
Names & synonyms
5-bromo-6-(3-methoxyphenyl)pyridin-3-amine3-Amino-5-bromo-6-(3-methoxyphenyl)pyridine1119089-48-3SCHEMBL2404738WGVTZYQBILULGS-UHFFFAOYSA-NDTXSID701267515CS-408695-Bromo-6-(3-methoxyphenyl)-3-pyridinamine
Database identifiers
- CAS
1119089-48-3- PubChem CID
- 58415901
- DTXSID
DTXSID701267515
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 227
Related reactions
2 records
Compound notes
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