Chemical ID: 5463900

c1ccc(cc1)NCc2ccccc2C#N
Chemical ID:
5463900
Name [?]:
2-(anilinomethyl)benzonitrile
SMILES [?]:
c1ccc(cc1)NCc2ccccc2C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H12N2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.53724
Area:407.098
Solvation:-1.64022
Coulombic:-17.7994
Bond Count [?]
All:17
Single:10
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:208.259
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.1
LogP (Chemaxon):3.21

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue