1-Cyclopropyl-1-(2-methoxy-4,5-dimethylphenyl)methanamine
Basic information
- CAS
535926-41-1- Standard SMILES
COc1cc(C)c(C)cc1C(N)C1CC1- InChIKey
WKQQYVUQVKNKGF-UHFFFAOYSA-N- Molecular formula
- C13H19NO
- Average molar mass
- 205.3 g/mol
- Monoisotopic mass
- 205.14666423
Names & identifiers
- Preferred name
- 1-Cyclopropyl-1-(2-methoxy-4,5-dimethylphenyl)methanamine
- IUPAC
- cyclopropyl-(2-methoxy-4,5-dimethylphenyl)methanamine
Names & synonyms
DTXSID401197941535926-41-11-Cyclopropyl-1-(2-methoxy-4,5-dimethylphenyl)methanamineBenzenemethanamine, I+/--cyclopropyl-2-methoxy-4,5-dimethyl-
Database identifiers
- CAS
535926-41-1- PubChem CID
- 3960700
- DTXSID
DTXSID401197941
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 215
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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