N-benzyl-3,5-dimethyl-1,2-oxazole-4-carboxamide

N-benzyl-3,5-dimethyl-1,2-oxazole-4-carboxamide

CAS: 81022-87-9

Formula: C13H14N2O2

SMILES: CC1=C(C(=O)NCC2=CC=CC=C2)C(C)=NO1

IUPAC: N-benzyl-3,5-dimethyl-1,2-oxazole-4-carboxamide

InChI: InChI=1S/C13H14N2O2/c1-9-12(10(2)17-15-9)13(16)14-8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,14,16)

Composition: C (67.81%), H (6.13%), N (12.17%), O (13.90%)

Molar Mass: 230.267

Atom Count: 31

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	230.105527699
Formal Charge	0
FSP3	0.23
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	GIMCMADGNGMRAZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.83
Topological Polar Surface Area	55.13
Polarizability	24.12
Ring Count	2
Rotatable Bond Count	3

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90%	<2 Days	81022-87-9		$51.35-$86.31$51.35$63.37$86.31