Chemical ID: 3999486

c1ccc(cc1)CN2CCN(CC2)CC#N
Chemical ID:
3999486
Name [?]:
2-(4-benzylpiperazin-1-yl)acetonitrile
SMILES [?]:
c1ccc(cc1)CN2CCN(CC2)CC#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H17N3
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.01853
Area:413.82
Solvation:-2.32698
Coulombic:-13.9453
Bond Count [?]
All:17
Single:13
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:215.294
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.91
LogP (Chemaxon):1.61

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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