N-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]cyclopropanecarboxamide

N-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]cyclopropanecarboxamide

CAS: 478079-69-5

Formula: C15H20FN3O

SMILES: CN1CCN(CC1)C1=C(F)C=C(NC(=O)C2CC2)C=C1

IUPAC: N-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]cyclopropanecarboxamide

InChI: InChI=1S/C15H20FN3O/c1-18-6-8-19(9-7-18)14-5-4-12(10-13(14)16)17-15(20)11-2-3-11/h4-5,10-11H,2-3,6-9H2,1H3,(H,17,20)

Composition: C (64.96%), H (7.27%), F (6.85%), N (15.15%), O (5.77%)

Molar Mass: 277.343

Atom Count: 40

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	277.159040439
Formal Charge	0
FSP3	0.53
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZLXFXEPKLDGSTM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.02
Topological Polar Surface Area	35.58
Polarizability	28.98
Ring Count	3
Rotatable Bond Count	3

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90%	<2 Days	478079-69-5		$51.35-$86.31$51.35$63.37$86.31