neratinib
CHEBI:CHEBI_61397
Definition
A quinoline compound having a cyano group at the 3-position, a 3-chloro-4-(2-pyridylmethoxy)anilino group at the 4-position, a 4-dimethylamino-trans-but-2-enoylamido group at the 6-position, and an ethoxy group at the 7-position.
Chemical Information
- Molecular Formula
- C30H29ClN6O3
- Molecular Mass
- 557.050
- Charge
- 0
- SMILES
- C1(=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC=C(C(=C3)Cl)OCC4=NC=CC=C4)OCC)NC(/C=C/CN(C)C)=O
- InChI
- InChI=1S/C30H29ClN6O3/c1-4-39-28-16-25-23(15-26(28)36-29(38)9-7-13-37(2)3)30(20(17-32)18-34-25)35-21-10-11-27(24(31)14-21)40-19-22-8-5-6-12-33-22/h5-12,14-16,18H,4,13,19H2,1-3H3,(H,34,35)(H,36,38)/b9-7+
- InChIKey
- JWNPDZNEKVCWMY-VQHVLOKHSA-N
Alternative Names
- (2E)-N-(4-{[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]amino}-3-cyano-7-ethoxyquinolin-6-yl)-4-(dimethylamino)but-2-enamide
- HKI 272
- HKI-272
- N-(4-(3-Chloro-4-(2-pyridinylmethoxy)anilino)-3-cyano-7-ethoxy-6-quinolyl)-4-(dimethylamino)-2-butenamide
- neratinib
Drug Classification
-
nitrileView Class →
CHEBI:18379
-
quinolinesView Class →
CHEBI:26513
-
t258187
-
t258426
Important Medical Information
⚕️ This information is sourced from ChEBI (Chemical Entities of Biological Interest) database and is intended for educational purposes only.
- Always consult with a healthcare professional before starting, stopping, or modifying any medication.
- Side effects may vary and this list may not be comprehensive.
- Drug interactions may occur with other medications.
Additional Identifiers
- DRON_00010000
- 1940643
- oboInOwl#hasDbXref
- Reaxys:9971763
- core#notation
- CHEBI:61397
Additional References
🔍 Click on any linked disease name to learn more about the conditions this medication is used to treat, or explore related drug classifications for more information about similar medications.
Additional Attributes
- has_treatment
- http://purl.obolibrary.org/obo/DOID_0060079
- rdf-schema#domain
- https://w3id.org/def/predibionto#has_side_effect30161
- owl#annotatedSource
- t259477
- owl#someValuesFrom
- t3174980
- oboInOwl#hasOBONamespace
- chebi_ontology
- DRON_00010000
- 1940643
- oboInOwl#hasDbXref
- Reaxys:9971763
- oboInOwl#id
- CHEBI:61397
- core#notation
- CHEBI:61397
- generic_name
- Neratinib Maleate
- rxcui
- 1940654
- product_type
- BULK INGREDIENT
- marketing_category
- BULK INGREDIENT
- listing_expiration_date
- 20241231
- route
- ORAL
- dosage_form
- POWDER
- pharm_class
- Kinase Inhibitors [MoA]
- active_ingredient_strength
- 5 kg/5kg
- marketing_start_date
- 20230515
- package_marketing_start_date
- 15-MAY-23
- labeler_name
- Pliva Hrvatska d.o.o.
- brand_name
- Nerlynx
- brand_name_base
- Nerlynx
- product_ndc
- 11722-079
- application_number
- NDA208051
- manufacturer_name
- Puma Biotechnology, Inc.
- spl_id
- f2b16ab2-2fd0-434d-9e28-aae252bebcb0
- active_ingredient_name
- NERATINIB MALEATE
- package_ndc
- 11722-079-00
- package_description
- 5 kg in 1 CARTON (11722-079-00)
- unii
- 9RM7XY23ZS
- spl_set_id
- d1e41dcf-e82a-47c2-a0ad-6c6eef621834
- upc
- 0370437240264
- RO_0000087
- http://purl.obolibrary.org/obo/CHEBI_38637
- oboInOwl#inSubset
- http://purl.obolibrary.org/obo/chebi#3_STAR
- 22-rdf-syntax-ns#type
- http://www.w3.org/2002/07/owl#Class