N-methoxy-N-methylisoquinoline-3-carboxamide

N-methoxy-N-methylisoquinoline-3-carboxamide

CAS: 362057-20-3

Formula: C12H12N2O2

SMILES: CON(C)C(=O)C1=NC=C2C=CC=CC2=C1

IUPAC: N-methoxy-N-methylisoquinoline-3-carboxamide

InChI: InChI=1S/C12H12N2O2/c1-14(16-2)12(15)11-7-9-5-3-4-6-10(9)8-13-11/h3-8H,1-2H3

Composition: C (66.65%), H (5.59%), N (12.96%), O (14.80%)

Molar Mass: 216.24

Atom Count: 28

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	216.089877634
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	BWOWOLLMMZBHAQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.2
Topological Polar Surface Area	42.43
Polarizability	24.15
Ring Count	2
Rotatable Bond Count	2

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95%	<5 Days	362057-20-3		$1,700.00-$2,970.00$1,700.00$2,310.00$2,970.00