Chemical ID: 7290236

CC(C)(C)NC(=O)C1CCN(CC1)S(=O)(=O)c2ccccc2F
Chemical ID:
7290236
Name [?]:
1-(2-fluorophenyl)sulfonyl-N-tert-butyl-piperidine-4-carboxamide
SMILES [?]:
CC(C)(C)NC(=O)C1CCN(CC1)S(=O)(=O)c2ccccc2F
InChi [?]:
InChI=1/C16H23FN2O3S/c1-16(2,3)18-15(20)12-8-10-19(11-9-12)23(21,22)14-7-5-4-6-13(14)17/h4-7,12H,8-11H2,1-3H3,(H,18,20)
InChi Info:
AuxInfo=1/1/N:1,3,4,20,19,21,18,9,13,10,12,8,22,17,6,2,23,5,11,7,15,16,14/E:(1,2,3)(8,9)(10,11)(21,22)/CRV:23.6/rA:23nCCCCNCOCCCNCCSOOCCCCCCF/rB:s1;s2;s2;s2;s5;d6;s6;s8;s9;s10;s11;s8s12;s11;d14;d14;s14;s17;d18;s19;d20;d17s21;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H23FN2O3S
All Atoms:46
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.21292
Area:509.82
Solvation:-3.53258
Coulombic:-31.6695
Bond Count [?]
All:24
Single:18
Double:6
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:342.43
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.28
LogP (Chemaxon):1.58

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