1-benzoylpiperidine-4-carboxylic acid

1-benzoylpiperidine-4-carboxylic acid

CAS: 5274-99-7

Formula: C13H15NO3

SMILES: OC(=O)C1CCN(CC1)C(=O)C1=CC=CC=C1

IUPAC: 1-benzoylpiperidine-4-carboxylic acid

InChI: InChI=1S/C13H15NO3/c15-12(10-4-2-1-3-5-10)14-8-6-11(7-9-14)13(16)17/h1-5,11H,6-9H2,(H,16,17)

Composition: C (66.94%), H (6.48%), N (6.00%), O (20.58%)

Molar Mass: 233.267

Atom Count: 32

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	233.105193347
Formal Charge	0
FSP3	0.38
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	ZTGMNCCDDKBPML-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.31
Topological Polar Surface Area	57.61
Polarizability	24.01
Ring Count	2
Rotatable Bond Count	2

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