5-bromo-N,N-dimethylpyridine-2-carboxamide

5-bromo-N,N-dimethylpyridine-2-carboxamide

CAS: 845305-86-4

Formula: C8H9BrN2O

SMILES: CN(C)C(=O)C1=CC=C(Br)C=N1

IUPAC: 5-bromo-N,N-dimethylpyridine-2-carboxamide

InChI: InChI=1S/C8H9BrN2O/c1-11(2)8(12)7-4-3-6(9)5-10-7/h3-5H,1-2H3

Composition: C (41.95%), H (3.96%), Br (34.88%), N (12.23%), O (6.98%)

Molar Mass: 229.077

Atom Count: 21

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	227.989826
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KQRHFAPOFNDZHY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.02
Topological Polar Surface Area	33.2
Polarizability	18.86
Ring Count	1
Rotatable Bond Count	1

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