1-(4-methanesulfonylnaphthalen-1-yl)piperidine-4-carboxamide

1-(4-methanesulfonylnaphthalen-1-yl)piperidine-4-carboxamide

CAS: 1000018-32-5

Formula: C17H20N2O3S

SMILES: CS(=O)(=O)C1=C2C=CC=CC2=C(C=C1)N1CCC(CC1)C(N)=O

IUPAC: 1-(4-methanesulfonylnaphthalen-1-yl)piperidine-4-carboxamide

InChI: InChI=1S/C17H20N2O3S/c1-23(21,22)16-7-6-15(13-4-2-3-5-14(13)16)19-10-8-12(9-11-19)17(18)20/h2-7,12H,8-11H2,1H3,(H2,18,20)

Composition: C (61.42%), H (6.06%), N (8.43%), O (14.44%), S (9.64%)

Molar Mass: 332.42

Atom Count: 43

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	332.119463686
Formal Charge	0
FSP3	0.35
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	BNOSSKYGNDIFCV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	91.14
Topological Polar Surface Area	80.47
Polarizability	36.48
Ring Count	3
Rotatable Bond Count	3

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