N-(pyridin-2-ylmethyl)-6-(trifluoromethyl)pyridine-3-carboxamide

N-(pyridin-2-ylmethyl)-6-(trifluoromethyl)pyridine-3-carboxamide

CAS: 870516-96-4

Formula: C13H10F3N3O

SMILES: FC(F)(F)C1=NC=C(C=C1)C(=O)NCC1=NC=CC=C1

IUPAC: N-[(pyridin-2-yl)methyl]-6-(trifluoromethyl)pyridine-3-carboxamide

InChI: InChI=1S/C13H10F3N3O/c14-13(15,16)11-5-4-9(7-18-11)12(20)19-8-10-3-1-2-6-17-10/h1-7H,8H2,(H,19,20)

Composition: C (55.52%), H (3.58%), F (20.27%), N (14.94%), O (5.69%)

Molar Mass: 281.238

Atom Count: 30

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	281.077596443
Formal Charge	0
FSP3	0.15
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	BQEOEVQAVFZSLA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.41
Topological Polar Surface Area	54.88
Polarizability	23.99
Ring Count	2
Rotatable Bond Count	4

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