Chemical ID: 5104808

C1CC1C(CN2CCNCC2)O
Chemical ID:
5104808
Name [?]:
1-cyclopropyl-2-piperazin-1-yl-ethanol
SMILES [?]:
C1CC1C(CN2CCNCC2)O
InChi [?]:
InChI=1/C9H18N2O/c12-9(8-1-2-8)7-11-5-3-10-4-6-11/h8-10,12H,1-7H2
InChi Info:
AuxInfo=1/0/N:1,2,8,10,7,11,5,3,4,9,6,12/E:(1,2)(3,4)(5,6)/rA:12cCCCCCNCCNCCO/rB:s1;s1s2;s3;s4;s5;s6;s7;s8;s9;s6s10;s4;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H18N2O
All Atoms:12
Heavy Atoms:12
Chiral Atoms:1
ZAP Information [?]
Total:6.05709
Area:345.137
Solvation:-2.57132
Coulombic:-29.7647
Bond Count [?]
All:13
Single:13
Double:0
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:170.252
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:-0.47
LogP (Chemaxon):-0.07

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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