Chemical ID: 5086394

c1cc(c(cc1Cl)Cl)OCC(CN2CCCCC2)O
Chemical ID:
5086394
Name [?]:
1-(2,4-dichlorophenoxy)-3-(1-piperidyl)propan-2-ol
SMILES [?]:
c1cc(c(cc1Cl)Cl)OCC(CN2CCCCC2)O
InChi [?]:
InChI=1/C14H19Cl2NO2/c15-11-4-5-14(13(16)8-11)19-10-12(18)9-17-6-2-1-3-7-17/h4-5,8,12,18H,1-3,6-7,9-10H2
InChi Info:
AuxInfo=1/0/N:16,15,17,1,2,14,18,5,12,10,6,11,4,3,7,8,13,19,9/E:(2,3)(6,7)/rA:19cCCCCCCClClOCCCNCCCCCO/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;s9;s10;s11;s12;s13;s14;s15;s16;s13s17;s11;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H19Cl2NO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:7.93668
Area:506.466
Solvation:-4.72497
Coulombic:-29.3174
Bond Count [?]
All:20
Single:17
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:304.212
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.23
LogP (Chemaxon):3.16

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