Compound C13H13N3O2

2-methyl-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)prop-2-enamide

CAS: 3331-54-2

Molecular Formula	`C13H13N3O2`
Molecular Weight	243.26 g/mol
LogP	1.5
Topological Polar Surface Area	61.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	243.10077
Heavy Atoms	18
Complexity	408.0

Chemical Identifiers

CAS Number	3331-54-2
SMILES	`CC(=C)C(=O)NC1=NN(C(=O)C1)C2=CC=CC=C2`
InChIKey	`MXLQAWXKAKUDHC-UHFFFAOYSA-N`

📖 Product Overview

Compound C13H13N3O2 (CAS: 3331-54-2) is a chemical compound with molecular formula C13H13N3O2 and molecular weight 243.26 g/mol. Its IUPAC systematic name is 2-methyl-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)prop-2-enamide. LogP 1.5 Topological Polar Surface Area 61.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 3 Exact Mass 243.10077 Heavy Atoms 18 Complexity 408.0 InChI Key: MXLQAWXKAKUDHC-UHFFFAOYSA-N. SMILES: CC(=C)C(=O)NC1=NN(C(=O)C1)C2=CC=CC=C2.

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