Chemical ID: 7117422

CC(C)N1CCN(CC1)CCO
Chemical ID:
7117422
Name [?]:
2-(4-isopropylpiperazin-1-yl)ethanol
SMILES [?]:
CC(C)N1CCN(CC1)CCO
InChi [?]:
InChI=1/C9H20N2O/c1-9(2)11-5-3-10(4-6-11)7-8-12/h9,12H,3-8H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,6,8,5,9,10,11,2,7,4,12/E:(1,2)(3,4)(5,6)/rA:12nCCCNCCNCCCCO/rB:s1;s2;s2;s4;s5;s6;s7;s4s8;s7;s10;s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H20N2O
All Atoms:32
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:5.83157
Area:348.54
Solvation:-2.88192
Coulombic:-25.4477
Bond Count [?]
All:12
Single:12
Double:0
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:172.268
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:-0.12
LogP (Chemaxon):0.27

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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