Chemical ID: 6719360

CC1CCCC(N1C(=O)Oc2ccccc2)C
Chemical ID:
6719360
Name [?]:
phenyl 2,6-dimethylpiperidine-1-carboxylate
SMILES [?]:
CC1CCCC(N1C(=O)Oc2ccccc2)C
InChi [?]:
InChI=1/C14H19NO2/c1-11-7-6-8-12(2)15(11)14(16)17-13-9-4-3-5-10-13/h3-5,9-12H,6-8H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,17,14,13,15,4,3,5,12,16,2,6,11,8,7,9,10/E:(1,2)(4,5)(7,8)(9,10)(11,12)/rA:17cCCCCCCNCOOCCCCCCC/rB:s1;s2;s3;s4;s5;s2s6;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s6;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H19NO2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:2
ZAP Information [?]
Total:8.96736
Area:403.633
Solvation:-1.12347
Coulombic:-31.3288
Bond Count [?]
All:18
Single:14
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:233.306
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.37
LogP (Chemaxon):3.32

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