N-(5-bromo-2-methoxybenzyl)-2-methylcyclohexanamine
Basic information
- CAS
5570-87-6- Standard SMILES
COc1ccc(Br)cc1CNC1CCCCC1C- InChIKey
UKLQDVAMCDQMPL-UHFFFAOYSA-N- Molecular formula
- C15H22BrNO
- Average molar mass
- 312.24 g/mol
- Monoisotopic mass
- 311.08848
Names & identifiers
- Preferred name
- N-(5-bromo-2-methoxybenzyl)-2-methylcyclohexanamine
- IUPAC
- N-[(5-bromo-2-methoxyphenyl)methyl]-2-methylcyclohexan-1-amine
Names & synonyms
N-(5-bromo-2-methoxybenzyl)-2-methylcyclohexanamine5570-87-6N-[(5-bromo-2-methoxyphenyl)methyl]-2-methylcyclohexan-1-amineAG-690/11822393Oprea1_045068Oprea1_319997DTXSID40386133STK145670AKOS003260056AKOS017273286ST45144966[(5-bromo-2-methoxyphenyl)methyl](2-methylcyclohexyl)amine
Show more names
N-(5-bromo-2-methoxybenzyl)-N-(2-methylcyclohexyl)amine
Database identifiers
- CAS
5570-87-6- PubChem CID
- 2853553
- DTXSID
DTXSID40386133
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 249
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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