Chemical ID: 5104812

CC(C)(C)C(CN1CCNCC1)O
Chemical ID:
5104812
Name [?]:
3,3-dimethyl-1-piperazin-1-yl-butan-2-ol
SMILES [?]:
CC(C)(C)C(CN1CCNCC1)O
InChi [?]:
InChI=1/C10H22N2O/c1-10(2,3)9(13)8-12-6-4-11-5-7-12/h9,11,13H,4-8H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,3,4,9,11,8,12,6,5,2,10,7,13/E:(1,2,3)(4,5)(6,7)/rA:13cCCCCCCNCCNCCO/rB:s1;s2;s2;s2;s5;s6;s7;s8;s9;s10;s7s11;s5;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H22N2O
All Atoms:13
Heavy Atoms:13
Chiral Atoms:1
ZAP Information [?]
Total:6.58336
Area:363.812
Solvation:-2.51195
Coulombic:-30.4854
Bond Count [?]
All:13
Single:13
Double:0
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:186.295
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:0.27
LogP (Chemaxon):0.94

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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