Chemical ID: 4227616

Cc1ccc(c(c1)C)OCC(CN2CCCCC2)O
Chemical ID:
4227616
Name [?]:
1-(2,4-dimethylphenoxy)-3-(1-piperidyl)propan-2-ol
SMILES [?]:
Cc1ccc(c(c1)C)OCC(CN2CCCCC2)O
InChi [?]:
InChI=1/C16H25NO2/c1-13-6-7-16(14(2)10-13)19-12-15(18)11-17-8-4-3-5-9-17/h6-7,10,15,18H,3-5,8-9,11-12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,8,16,15,17,3,4,14,18,7,12,10,2,6,11,5,13,19,9/E:(4,5)(8,9)/rA:19cCCCCCCCCOCCCNCCCCCO/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;s10;s11;s12;s13;s14;s15;s16;s13s17;s11;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H25NO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:7.64637
Area:480.377
Solvation:-4.36306
Coulombic:-29.1638
Bond Count [?]
All:20
Single:17
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:263.375
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.64
LogP (Chemaxon):3.06

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