2-n-Butyl-3-(dimethylamino)-5,6-methylenedioxyindene
Basic information
- CAS
66789-16-0- Standard SMILES
CCCCC1=C(N(C)C)c2cc3c(cc2C1)OCO3- InChIKey
XBXGLTALODVHEW-UHFFFAOYSA-N- Molecular formula
- C16H21NO2
- Average molar mass
- 259.34 g/mol
- Monoisotopic mass
- 259.15722891
Overview
affects calcium-induced arrhythmias; RN given refers to parent cpd
Names & identifiers
- Preferred name
- 2-n-Butyl-3-(dimethylamino)-5,6-methylenedioxyindene
- IUPAC
- 6-butyl-N,N-dimethyl-5H-cyclopenta[f][1,3]benzodioxol-7-amine
- English name
- 2-n-butyl-3-(dimethylamino)-5,6-methylenedioxyindene
- Molecular formula
- C16H21NO2
- Molecular weight
- 259.34
Names & synonyms
MDI-A66789-16-02-n-Butyl-3-(dimethylamino)-5,6-methylenedioxyindeneDTXSID20216909RefChem:88434DTXCID00139400CHEMBL3403716-butyl-n,n-dimethyl-5h-indeno[5,6-d][1,3]dioxol-7-amineSCHEMBL296338555H-Indeno(5,6-d)-1,3-dioxol-7-amine, 6-butyl-N,N-dimethyl-BDBM502254872-butyl-3-dimethylamino-5,6-methylene-dioxyindene
Show more names
5H-Indeno[5,6-d]-1,3-dioxol-7-amine, 6-butyl-N,N-dimethyl-
6-Butyl-N,N-dimethyl-2H,5H-indeno[5,6-d][1,3]dioxol-7-amine
Database identifiers
- CAS
66789-16-0- PubChem CID
- 128346
- DTXSID
DTXSID20216909- ChEMBL
CHEMBL340371- Nikkaji
- J395.480C
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 364
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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