Chemical ID: 7042783

Cc1cccc(c1)OCC(CN2CCN(CC2)C)O
Chemical ID:
7042783
Name [?]:
1-(3-methylphenoxy)-3-(4-methylpiperazin-1-yl)-propan-2-ol
SMILES [?]:
Cc1cccc(c1)OCC(CN2CCN(CC2)C)O
InChi [?]:
InChI=1/C15H24N2O2/c1-13-4-3-5-15(10-13)19-12-14(18)11-17-8-6-16(2)7-9-17/h3-5,10,14,18H,6-9,11-12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,18,4,3,5,14,16,13,17,7,11,9,2,10,6,15,12,19,8/E:(6,7)(8,9)/rA:19cCCCCCCCOCCCNCCNCCCO/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;s10;s11;s12;s13;s14;s15;s12s16;s15;s10;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H24N2O2
All Atoms:43
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:7.12937
Area:478.919
Solvation:-4.8436
Coulombic:-33.554
Bond Count [?]
All:20
Single:17
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:264.363
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.2
LogP (Chemaxon):1.67

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