4-Bromo-2-[4-(2-methyl-pyrrolidin-1-yl)-but-1-ynyl]-phenylamine

HCID 21980093

Basic information

Standard SMILES
CC1CCCN1CCC#Cc1cc(Br)ccc1N
InChIKey
GCNAYCGEPITKKF-UHFFFAOYSA-N
Molecular formula
C15H19BrN2
Average molar mass
307.23 g/mol

Names & identifiers

Preferred name
4-Bromo-2-[4-(2-methyl-pyrrolidin-1-yl)-but-1-ynyl]-phenylamine
IUPAC
4-bromo-2-[4-(2-methylpyrrolidin-1-yl)but-1-ynyl]aniline

Names & synonyms

SCHEMBL489021GCNAYCGEPITKKF-UHFFFAOYSA-N4-bromo-2-[4-(2-methyl-pyrrolidin-1-yl )-but-1-ynyl]-phenylamine4-bromo-2-[4-(2-methyl-pyrrolidin-1-yl)-but-1-ynyl]-phenylamine

Database identifiers

PubChem CID
21980093

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
29.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
18

Related reactions

11 records

Linked notes

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