1-(4-fluoro-2-methanesulfonylphenyl)piperidine-4-carboxamide

1-(4-fluoro-2-methanesulfonylphenyl)piperidine-4-carboxamide

CAS: 914637-65-3

Formula: C13H17FN2O3S

SMILES: CS(=O)(=O)C1=C(C=CC(F)=C1)N1CCC(CC1)C(N)=O

IUPAC: 1-(4-fluoro-2-methanesulfonylphenyl)piperidine-4-carboxamide

InChI: InChI=1S/C13H17FN2O3S/c1-20(18,19)12-8-10(14)2-3-11(12)16-6-4-9(5-7-16)13(15)17/h2-3,8-9H,4-7H2,1H3,(H2,15,17)

Composition: C (51.99%), H (5.71%), F (6.33%), N (9.33%), O (15.98%), S (10.67%)

Molar Mass: 300.35

Atom Count: 37

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	300.094391752
Formal Charge	0
FSP3	0.46
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	NESCEWNXAYDQRB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	74.91
Topological Polar Surface Area	80.47
Polarizability	28.75
Ring Count	2
Rotatable Bond Count	3

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