N-(2H-1,3-benzodioxol-5-ylmethyl)-2-methylpentanamide

N-(2H-1,3-benzodioxol-5-ylmethyl)-2-methylpentanamide

Formula: C14H19NO3

SMILES: CCCC(C)C(=O)NCC1=CC=C2OCOC2=C1

IUPAC: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-methylpentanamide

InChI: InChI=1/C14H19NO3/c1-3-4-10(2)14(16)15-8-11-5-6-12-13(7-11)18-9-17-12/h5-7,10H,3-4,8-9H2,1-2H3,(H,15,16)

Composition: C (67.45%), H (7.68%), N (5.62%), O (19.25%)

Molar Mass: 249.31

Atom Count: 37

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	249.136493476
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	XWXDOICPSDSPFB-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.15
Topological Polar Surface Area	47.56
Polarizability	26.89
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H19NO3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00