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N-(5-bromo-6-methylpyridin-2-yl)propanamide

N-(5-bromo-6-methylpyridin-2-yl)propanamide

CAS: 638140-68-8

Formula: C9H11BrN2O

SMILES: CCC(=O)NC1=NC(C)=C(Br)C=C1

IUPAC: N-(5-bromo-6-methylpyridin-2-yl)propanamide

InChI: InChI=1S/C9H11BrN2O/c1-3-9(13)12-8-5-4-7(10)6(2)11-8/h4-5H,3H2,1-2H3,(H,11,12,13)

Composition: C (44.47%), H (4.56%), Br (32.87%), N (11.52%), O (6.58%)

Molar Mass: 243.104

Atom Count: 24

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 242.005476
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey DUJQWEAOAOXMLF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.92
Topological Polar Surface Area 41.99
Polarizability 20.78
Ring Count 1
Rotatable Bond Count 2

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