6-N-Benzylamino-1-(4'-phenylbutoxy)hexane

C₂₃H₃₃NOCAS 97664-55-6339.52 g/mol

Open in Covalent MOL file

Ether Secondary amine

Properties

Molecular formula: C₂₃H₃₃NO
Molar mass: 339.52 g/mol
Exact mass: 339.2562 Da
logP: 5.38Crippen estimate
Polar surface area: 21.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 14

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

97664-55-6

SMILES

C1=CC=C(C=C1)CCCCOCCCCCCNCC2=CC=CC=C2

InChIKey

JWLIKZBRVQRFNF-UHFFFAOYSA-N

InChI

InChI=1S/C23H33NO/c1(10-18-24-21-23-16-7-4-8-17-23)2-11-19-25-20-12-9-15-22-13-5-3-6-14-22/h3-8,13-14,16-17,24H,1-2,9-12,15,18-21H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

N-Benzyl-6-(4-phenylbutoxy)hexan-1-amine

Work with 6-N-Benzylamino-1-(4'-phenylbutoxy)hexane

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Benzylphenethylamine3647-71-057 % similar Benzathine140-28-355 % similar N-Benzyl-1,3-propanediamine13910-48-053 % similar N-Butylbenzylamine2403-22-753 % similar 3-(Benzylamino)propanol4720-29-053 % similar Benzylethanolamine104-63-248 % similar Dibenzylamine103-49-148 % similar N-Benzylethylenediamine4152-09-447 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Evocarpine15266-38-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook