Chemical ID: 7088404

C1CN(CCN1)C(=O)CCl
Chemical ID:
7088404
Name [?]:
2-chloro-1-piperazin-1-yl-ethanone
SMILES [?]:
C1CN(CCN1)C(=O)CCl
InChi [?]:
InChI=1/C6H11ClN2O/c7-5-6(10)9-3-1-8-2-4-9/h8H,1-5H2
InChi Info:
AuxInfo=1/0/N:1,5,2,4,9,7,10,6,3,8/E:(1,2)(3,4)/rA:10nCCNCCNCOCCl/rB:s1;s2;s3;s4;s1s5;s3;d7;s7;s9;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H11ClN2O
All Atoms:21
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.21576
Area:313.201
Solvation:-2.61428
Coulombic:-23.5419
Bond Count [?]
All:10
Single:9
Double:1
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:162.617
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:-0.51
LogP (Chemaxon):-0.51

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Descriptor Annotations

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