5-Methyl-4-{[4-(cyclopropylidenemethyl)phenyl]methyl}-1,2-dihydro-3h-pyrazol-3-one

HCID 21989704
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Basic information

Standard SMILES
Cc1[nH][nH]c(=O)c1Cc1ccc(C=C2CC2)cc1
InChIKey
JQDDUBLKFZRUMK-UHFFFAOYSA-N
Molecular formula
C15H16N2O
Average molar mass
240.3 g/mol

Names & identifiers

Preferred name
5-Methyl-4-{[4-(cyclopropylidenemethyl)phenyl]methyl}-1,2-dihydro-3h-pyrazol-3-one
IUPAC
4-[[4-(cyclopropylidenemethyl)phenyl]methyl]-5-methyl-1,2-dihydropyrazol-3-one

Names & synonyms

SCHEMBL4663233JQDDUBLKFZRUMK-UHFFFAOYSA-N5-methyl-4-{[4-(cyclopropylidene-methyl)phenyl]methyl}-1,2-dihydro-3h-pyrazol-3-one5-methyl-4-{[4-(cyclopropylidenemethyl)phenyl]methyl}-1,2-dihydro-3h-pyrazol-3-one

Database identifiers

PubChem CID
21989704

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
41.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
18

Related reactions

2 records
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Compound notes

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