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2-bromo-N-[3-(piperidine-1-carbonyl)phenyl]acetamide

2-bromo-N-[3-(piperidine-1-carbonyl)phenyl]acetamide

CAS: 1138443-37-4

Formula: C14H17BrN2O2

SMILES: BrCC(=O)NC1=CC(=CC=C1)C(=O)N1CCCCC1

IUPAC: 2-bromo-N-[3-(piperidine-1-carbonyl)phenyl]acetamide

InChI: InChI=1S/C14H17BrN2O2/c15-10-13(18)16-12-6-4-5-11(9-12)14(19)17-7-2-1-3-8-17/h4-6,9H,1-3,7-8,10H2,(H,16,18)

Composition: C (51.71%), H (5.27%), Br (24.57%), N (8.61%), O (9.84%)

Molar Mass: 325.206

Atom Count: 36

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 324.047341
Formal Charge 0
FSP3 0.43
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey PDLVWKNGSPWVRR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 79.67
Topological Polar Surface Area 49.41
Polarizability 29.27
Ring Count 2
Rotatable Bond Count 3

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