Carpropamide

HCID 449402

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Basic information

CAS: 127640-90-8
Standard SMILES: CC[C@@]1(C(=O)N[C@H](C)c2ccc(Cl)cc2)[C@@H](C)C1(Cl)Cl
InChIKey: RXDMAYSSBPYBFW-RULNRJAQSA-N
Molecular formula: C15H18Cl3NO
Average molar mass: 334.7 g/mol
Monoisotopic mass: 333.045397

Overview

(1S,3R)-2,2-dichloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-1-ethyl-3-methylcyclopropanecarboxamide is a carpropamid and a member of monochlorobenzenes.

Names & identifiers

Preferred name: Carpropamide
IUPAC: trans-(1S,3R)-2,2-dichloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-1-ethyl-3-methylcyclopropane-1-carboxamide

Names & synonyms

CARPROPAMIDERefChem:574711KTU-3616B(1S,3R)-2,2-dichloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-1-ethyl-3-methylcyclopropanecarboxamide127640-90-8Carpropamid, (1S,3R,1'R)-UNII-4748U7LZ6E4748U7LZ6E((1RS,3SR)-2,2-DICHLORO-N-[(R)-1-(4-CHLOROPHENYL)ETHYL]-1-ETHYL-3-METHYLCYCLOPROPANECARBOXAMIDE(1S,3R)-2,2-dichloro-N-[(1R)-1-(4-chlorophenyl)ethyl]-1-ethyl-3-methylcyclopropane-1-carboxamideCHEMBL147792Cyclopropanecarboxamide, 2,2-dichloro-N-((1R)-1-(4-chlorophenyl)ethyl)-1-ethyl-3-methyl-, (1S,3R)-

Show more names

2std7stdSCHEMBL343456CHEBI:47351DTXSID501030562BDBM50086741DB02946Q15632772

Database identifiers

CAS: 127640-90-8
PubChem CID: 449402
DTXSID: DTXSID501030562
ChEMBL: CHEMBL147792
ChEBI: CHEBI:47351

Properties

Computed structural properties

XLogP: 4.5
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 4
Heavy atoms: 20
Formal charge: 0
Complexity: 379

Experimental & physicochemical properties

DrugsPharmaceuticals -> Listed in ZINC15

Pesticides · 2 items

Fungicides

Active substance -> EU Pesticides database: Not approved

Related reactions

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Compound notes

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