2-(2H-1,3-benzodioxol-5-yl)-N-cyclopentylquinoline-4-carboxamide

2-(2H-1,3-benzodioxol-5-yl)-N-cyclopentylquinoline-4-carboxamide

Formula: C22H20N2O3

SMILES: O=C(NC1CCCC1)C1=CC(=NC2=CC=CC=C12)C1=CC=C2OCOC2=C1

IUPAC: 2-(2H-1,3-benzodioxol-5-yl)-N-cyclopentylquinoline-4-carboxamide

InChI: InChI=1S/C22H20N2O3/c25-22(23-15-5-1-2-6-15)17-12-19(24-18-8-4-3-7-16(17)18)14-9-10-20-21(11-14)27-13-26-20/h3-4,7-12,15H,1-2,5-6,13H2,(H,23,25)

Composition: C (73.32%), H (5.59%), N (7.77%), O (13.32%)

Molar Mass: 360.413

Atom Count: 47

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	360.147392512
Formal Charge	0
FSP3	0.27
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	YYWJRBYMKCKNIR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.9
Topological Polar Surface Area	60.45
Polarizability	41.7
Ring Count	5
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C22H20N2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00