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N-(3-bromophenyl)piperidine-4-carboxamide

N-(3-bromophenyl)piperidine-4-carboxamide

CAS: 1016503-28-8

Formula: C12H15BrN2O

SMILES: BrC1=CC=CC(NC(=O)C2CCNCC2)=C1

IUPAC: N-(3-bromophenyl)piperidine-4-carboxamide

InChI: InChI=1S/C12H15BrN2O/c13-10-2-1-3-11(8-10)15-12(16)9-4-6-14-7-5-9/h1-3,8-9,14H,4-7H2,(H,15,16)

Composition: C (50.90%), H (5.34%), Br (28.22%), N (9.89%), O (5.65%)

Molar Mass: 283.169

Atom Count: 31

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 282.036776
Formal Charge 0
FSP3 0.42
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey PNZFKESQFYGSLC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 68.98
Topological Polar Surface Area 41.13
Polarizability 26.13
Ring Count 2
Rotatable Bond Count 2

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