Chemical ID: 7117435

CC(C)CN1CCN(CC1)CCO
Chemical ID:
7117435
Name [?]:
2-(4-isobutylpiperazin-1-yl)ethanol
SMILES [?]:
CC(C)CN1CCN(CC1)CCO
InChi [?]:
InChI=1/C10H22N2O/c1-10(2)9-12-5-3-11(4-6-12)7-8-13/h10,13H,3-9H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,7,9,6,10,11,12,4,2,8,5,13/E:(1,2)(3,4)(5,6)/rA:13nCCCCNCCNCCCCO/rB:s1;s2;s2;s4;s5;s6;s7;s8;s5s9;s8;s11;s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H22N2O
All Atoms:35
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.59819
Area:377.332
Solvation:-2.8351
Coulombic:-25.9913
Bond Count [?]
All:13
Single:13
Double:0
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:186.295
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:0.08
LogP (Chemaxon):0.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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