(2E)-2-cyano-N-(3-ethoxyphenyl)-3-[4-(pyrrolidin-1-yl)phenyl]prop-2-enamide

(2E)-2-cyano-N-(3-ethoxyphenyl)-3-[4-(pyrrolidin-1-yl)phenyl]prop-2-enamide

Formula: C22H23N3O2

SMILES: CCOC1=CC=CC(NC(=O)C(=CC2=CC=C(C=C2)N2CCCC2)C#N)=C1

IUPAC: (2E)-2-cyano-N-(3-ethoxyphenyl)-3-[4-(pyrrolidin-1-yl)phenyl]prop-2-enamide

InChI: InChI=1S/C22H23N3O2/c1-2-27-21-7-5-6-19(15-21)24-22(26)18(16-23)14-17-8-10-20(11-9-17)25-12-3-4-13-25/h5-11,14-15H,2-4,12-13H2,1H3,(H,24,26)/b18-14+

Composition: C (73.11%), H (6.41%), N (11.63%), O (8.85%)

Molar Mass: 361.445

Atom Count: 50

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	361.179026993
Formal Charge	0
FSP3	0.27
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	VBBRWHPZHVUFIL-NBVRZTHBSA-N
Lipinski's Rule of Five	1
Molar Refractivity	109.57
Topological Polar Surface Area	65.36
Polarizability	40.21
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H23N3O2		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00