3-amino-5-methyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide

3-amino-5-methyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide

CAS: 400088-38-2

Formula: C12H11F3N4O

SMILES: CC1=C(C(=O)NC2=CC=CC(=C2)C(F)(F)F)C(N)=NN1

IUPAC: 3-amino-5-methyl-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide

InChI: InChI=1S/C12H11F3N4O/c1-6-9(10(16)19-18-6)11(20)17-8-4-2-3-7(5-8)12(13,14)15/h2-5H,1H3,(H,17,20)(H3,16,18,19)

Composition: C (50.71%), H (3.90%), F (20.05%), N (19.71%), O (5.63%)

Molar Mass: 284.242

Atom Count: 31

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	284.088495479
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	ZERFMNZBCUCHBV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.42
Topological Polar Surface Area	83.8
Polarizability	23.89
Ring Count	2
Rotatable Bond Count	3

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	400088-38-2		$51.35-$86.31$51.35$63.37$86.31