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2-Ethyl-5-phenyl-2H-pyrazole-3-carboxylic Acid Methoxy-methyl-amide

HCID 9878346
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCn1nc(-c2ccccc2)cc1C(=O)N(C)OC
InChIKey
YDUNXUUODPLOOP-UHFFFAOYSA-N
Molecular formula
C14H17N3O2
Average molar mass
259.3 g/mol

Names & identifiers

Preferred name
2-Ethyl-5-phenyl-2H-pyrazole-3-carboxylic Acid Methoxy-methyl-amide
IUPAC
1-ethyl-N-methoxy-N-methyl-3-phenylpyrazole-5-carboxamide

Names & synonyms

SCHEMBL6335180YDUNXUUODPLOOP-UHFFFAOYSA-N2-Ethyl-5-phenyl-2H-pyrazole-3-carboxylic Acid Methoxy-methyl-amide

Database identifiers

PubChem CID
9878346

Properties

Computed structural properties

XLogP
2
Topological polar surface area
47.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
19
Formal charge
0
Complexity
305

Related reactions

5 records
New reaction record
HRID 190752 reaction equation
HRID 190752As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 396405 reaction equation
HRID 396405As productuspto-grants-2003_08
HRID 396406 reaction equation
HRID 396406As reactantuspto-grants-2003_08
HRID 585118 reaction equation
HRID 585118As productuspto-grants-2005_08
HRID 585119 reaction equation
HRID 585119As reactantuspto-grants-2005_08

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes