Chemical ID: 4237537

CC(C)OCC(CN1CCN(CC1)C)O
Chemical ID:
4237537
Name [?]:
1-isopropoxy-3-(4-methylpiperazin-1-yl)-propan-2-ol
SMILES [?]:
CC(C)OCC(CN1CCN(CC1)C)O
InChi [?]:
InChI=1/C11H24N2O2/c1-10(2)15-9-11(14)8-13-6-4-12(3)5-7-13/h10-11,14H,4-9H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,14,10,12,9,13,7,5,2,6,11,8,15,4/E:(1,2)(4,5)(6,7)/rA:15cCCCOCCCNCCNCCCO/rB:s1;s2;s2;s4;s5;s6;s7;s8;s9;s10;s11;s8s12;s11;s6;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H24N2O2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:5.81097
Area:423.006
Solvation:-4.76418
Coulombic:-32.8931
Bond Count [?]
All:15
Single:15
Double:0
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:216.321
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:-0.27
LogP (Chemaxon):0.18

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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