Chemical ID: 4730121

c1cnccc1CNCCC#N
Chemical ID:
4730121
Name [?]:
3-(4-pyridylmethylamino)propanenitrile
SMILES [?]:
c1cnccc1CNCCC#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H11N3
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.55838
Area:360.917
Solvation:-2.46455
Coulombic:-15.0965
Bond Count [?]
All:12
Single:8
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:161.204
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:-0.07
LogP (Chemaxon):0.32

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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