cyprodinil (CHEBI:4045)

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ChEBI Name	cyprodinil

ChEBI ID	CHEBI:4045

Definition	A member of the class of aminopyrimidine that is N-phenylpyrimidin-2-amine carrying additional cyclopropyl and methyl substituents at positions 4 and 6 respectively. A broad spectrum fungicide used to control a range of pathogens including Tapesia yallundae, Botrytis spp., Alternaria spp. and Rhynchospium secalis. Whilst it is a recognised irritant no serious human health concerns have been identified. It is moderately toxic to birds as well as most aquatic organisms and earthworms, but it is not considered toxic to honeybees.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C14H15N3

Net Charge

Average Mass

225.28900

Monoisotopic Mass

225.12660

InChI

InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)

InChIKey

HAORKNGNJCEJBX-UHFFFAOYSA-N

SMILES

Cc1cc(nc(Nc2ccccc2)n1)C1CC1

Roles Classification
Chemical Role(s):	environmental contaminant Any minor or unwanted substance introduced into the environment that can have undesired effects. Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

Biological Role(s):	antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. aryl hydrocarbon receptor agonist An agonist that binds to and activates aryl hydrocarbon receptors (AhRs). xenobiotic A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means. fungicide A substance used to destroy fungal pests. (via pyrimidine fungicide ) antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. (via pyrimidine antifungal agent )

Application(s):	antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. fungicide A substance used to destroy fungal pests. (via pyrimidine fungicide )

ChEBI Ontology
Outgoing	cyprodinil (CHEBI:4045) has role antifungal agrochemical (CHEBI:86328) cyprodinil (CHEBI:4045) has role aryl hydrocarbon receptor agonist (CHEBI:72768) cyprodinil (CHEBI:4045) has role environmental contaminant (CHEBI:78298) cyprodinil (CHEBI:4045) has role xenobiotic (CHEBI:35703) cyprodinil (CHEBI:4045) is a aminopyrimidine (CHEBI:38338) cyprodinil (CHEBI:4045) is a anilinopyrimidine fungicide (CHEBI:87208) cyprodinil (CHEBI:4045) is a cyclopropanes (CHEBI:51454) cyprodinil (CHEBI:4045) is a secondary amino compound (CHEBI:50995)

IUPAC Name

4-cyclopropyl-6-methyl-N-phenylpyrimidin-2-amine

Synonyms	Sources
2-Anilino-4-cyclopropyl-6-methylpyrimidine	HMDB
4-Cyclopropyl-6-methyl-N-phenyl-2-pyrimidinamine	HMDB
HSDB 7019	ChemIDplus

Last Modified

29 July 2015

General Comment
2014-10-29	Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag