(2Z)-2-cyano-3-(dimethylamino)-N-(3-fluorophenyl)prop-2-enamide

(2Z)-2-cyano-3-(dimethylamino)-N-(3-fluorophenyl)prop-2-enamide

Formula: C12H12FN3O

SMILES: CN(C)C=C(C#N)C(=O)NC1=CC=CC(F)=C1

IUPAC: (2Z)-2-cyano-3-(dimethylamino)-N-(3-fluorophenyl)prop-2-enamide

InChI: InChI=1S/C12H12FN3O/c1-16(2)8-9(7-14)12(17)15-11-5-3-4-10(13)6-11/h3-6,8H,1-2H3,(H,15,17)/b9-8-

Composition: C (61.79%), H (5.19%), F (8.15%), N (18.02%), O (6.86%)

Molar Mass: 233.246

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	233.096440181
Formal Charge	0
FSP3	0.17
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XDFFQTGVACRSKQ-HJWRWDBZSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.54
Topological Polar Surface Area	56.13
Polarizability	23.01
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H12FN3O		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00