Compound Identification
SMILES
COC1=C(C)C(CN(CCC2=CC(Br)=CC=C2)C2=CC(Cl)=NC(N)=N2)=NC=C1C
InChIKey
InChIKey=LFCQMVMXDMHGTD-UHFFFAOYSA-N
Formula
C21H23BrClN5O
Mass
476.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
- Subclass 2-pyridylmethylamines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
2-pyridylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
2-pyridylmethylamines
Alternative Parents
Dialkylarylamines Methylpyridines Halopyrimidines Bromobenzenes Aminopyrimidines and derivatives Alkyl aryl ethers Imidolactams Aryl chlorides Aryl bromides Heteroaromatic compounds Azacyclic compounds Primary amines Organochlorides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-pyridylmethylamine - Dialkylarylamine - Alkyl aryl ether - Aminopyrimidine - Methylpyridine - Bromobenzene - Halobenzene - Halopyrimidine - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Imidolactam - Heteroaromatic compound - Azacycle - Ether - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Amine - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-pyridylmethylamines. These are aromatic heterocyclic compounds contaning a pyridine ring which is substituted at the 2-position with a methylamine.
External Descriptors
Not available