N-[2-(3,4-dimethoxyphenyl)ethyl]cyclohexanamine
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Basic information
- CAS
93285-86-0- Standard SMILES
COc1ccc(CCNC2CCCCC2)cc1OC- InChIKey
QYUUWFKPJWELGD-UHFFFAOYSA-N- Molecular formula
- C16H25NO2
- Average molar mass
- 263.37 g/mol
- Monoisotopic mass
- 263.18852904
Names & identifiers
- Preferred name
- N-[2-(3,4-dimethoxyphenyl)ethyl]cyclohexanamine
- IUPAC
- N-[2-(3,4-dimethoxyphenyl)ethyl]cyclohexanamine
- English name
- CYCLOHEXYL-[2-(3,4-DIMETHOXY-PHENYL)-ETHYL]-AMINE
- Molecular formula
- C16H25NO2
- Molecular weight
- 263.38
Names & synonyms
N-[2-(3,4-dimethoxyphenyl)ethyl]cyclohexanamine93285-86-0N-(3,4-Dimethoxyphenethyl)cyclohexanamine[2-(3,4-dimethoxyphenyl)ethyl]cyclohexylamineCyclohexyl-[2-(3,4-dimethoxy-phenyl)-ethyl]-amineOprea1_115957Oprea1_465590SCHEMBL1678220CHEMBL1907482DTXSID60354516HMS1692H14SBB012098
Show more names
TIMTEC-BB SBB012098CHEMBRDG-BB 5573007Benzeneethanamine, N-cyclohexyl-3,4-dimethoxy-N-(2-(3,4-DIMETHOXYPHENYL)ETHYL)CYCLOHEXANAMINEN-[2-(3,4-dimethoxyphenyl)ethyl]cyclohexanamine(SALTDATA: HBr)
STK145862AKOS000231316SB81627CS-0319036ST45095886AG-690/13701792BRD-K46336155-001-01-0
Database identifiers
- CAS
93285-86-0- PubChem CID
- 775290
- DTXSID
DTXSID60354516- ChEMBL
CHEMBL1907482
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 30.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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