N-Butyl-alpha-methylbenzeneethanamine
Basic information
- CAS
51799-33-8- Standard SMILES
CCCCNC(C)Cc1ccccc1- InChIKey
VIAVBPFRYASSKF-UHFFFAOYSA-N- Molecular formula
- C13H21N
- Average molar mass
- 191.31 g/mol
- Monoisotopic mass
- 191.16739967
Names & identifiers
- Preferred name
- N-Butyl-alpha-methylbenzeneethanamine
- IUPAC
- N-(1-phenylpropan-2-yl)butan-1-amine
- English name
- d-N-butylamphetamine
- Molecular weight
- 0
Names & synonyms
57378-21-9N-Butyl-alpha-methylbenzeneethanamineRefChem:1091650ButylamphetamineN-n-butylamphetamineN-(1-phenylpropan-2-yl)butan-1-amine51799-33-8d-N-Butylamphetamine1-Phenyl-2-butylaminopropaneNSC 30322BRN 23620071-Phenyl-2-n-butylamino-propan [German]
Show more names
N-Butyl-α-methylbenzeneethanamineN-(1-Methyl-2-phenylethyl)-1-butanamine
1-Phenyl-2-n-butylamino-propann-butylamphetaminePhenethylamine, N-butyl-alpha-methyl-Benzeneethanamine, N-butyl-alpha-methyl-Benzeneethanamine, N-butyl-.alpha.-methyl-4-12-00-02592 (Beilstein Handbook Reference)SCHEMBL4821348CHEMBL1907545
Database identifiers
- CAS
51799-33-8、57378-21-9- PubChem CID
- 94547
- DTXSID
DTXSID801024079- ChEMBL
CHEMBL1907545- Nikkaji
- J71.124A
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 127
Experimental & physicochemical properties
DrugsDEA NFLIS-Drug Category -> Phenethylamines (Amphetamines) (S)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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