tert-butyl {[4-bromo-1-(3-methoxypropyl)-1H-indol-3-yl]methyl}cyclopropylcarbamate

HCID 86645632

Basic information

Standard SMILES
COCCCn1cc(CN(C(=O)OC(C)(C)C)C2CC2)c2c(Br)cccc21
InChIKey
HEGYVYYWFIQIJH-UHFFFAOYSA-N
Molecular formula
C21H29BrN2O3
Average molar mass
437.4 g/mol
Monoisotopic mass
436.13616

Names & identifiers

Preferred name
tert-butyl {[4-bromo-1-(3-methoxypropyl)-1H-indol-3-yl]methyl}cyclopropylcarbamate
IUPAC
tert-butyl N-[[4-bromo-1-(3-methoxypropyl)indol-3-yl]methyl]-N-cyclopropylcarbamate

Names & synonyms

HEGYVYYWFIQIJH-UHFFFAOYSA-Ntert-butyl {[4-bromo-1-(3-methoxypropyl)-1H-indol-3-yl]methy}cyclopropylcarbamatetert-butyl {[4-bromo-1-(3-methoxypropyl)-1H-indol-3-yl]methyl}cyclopropylcarbamate

Database identifiers

PubChem CID
86645632

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
43.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
9
Heavy atoms
27

Related reactions

3 records

Compound notes

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