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2-[1-Ethyl-3-trifluoromethylpyrazol-5-yl carbamoyl]-3-methyl-N-(1-methylethyl)benzamide

HCID 22712062
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCn1nc(C(F)(F)F)cc1NC(=O)c1c(C)cccc1C(=O)NC(C)C
InChIKey
GSLJZQZLNZIPIZ-UHFFFAOYSA-N
Molecular formula
C18H21F3N4O2
Average molar mass
382.4 g/mol

Names & identifiers

Preferred name
2-[1-Ethyl-3-trifluoromethylpyrazol-5-yl carbamoyl]-3-methyl-N-(1-methylethyl)benzamide
IUPAC
2-N-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-3-methyl-1-N-propan-2-ylbenzene-1,2-dicarboxamide

Names & synonyms

2-[1-Ethyl-3-trifluoromethylpyrazol-5-yl carbamoyl]-3-methyl-N-(1-methylethyl)benzamideSCHEMBL3281672

Database identifiers

PubChem CID
22712062

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
76 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
27
Formal charge
0
Complexity
541

Related reactions

2 records
New reaction record
HRID 352448 reaction equation
HRID 352448As productuspto-grants-2004_06
HRID 1391644 reaction equation
HRID 1391644As productuspto-grants-2008_03

Compound notes

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