Chemical ID: 4523030

c1ccc(cc1)CN(Cc2ccccc2)C#N
Chemical ID:
4523030
Name [?]:
dibenzylaminoformonitrile
SMILES [?]:
c1ccc(cc1)CN(Cc2ccccc2)C#N
InChi [?]:
InChI=1/C15H14N2/c16-13-17(11-14-7-3-1-4-8-14)12-15-9-5-2-6-10-15/h1-10H,11-12H2
InChi Info:
AuxInfo=1/0/N:1,13,2,6,12,14,3,5,11,15,7,9,16,4,10,17,8/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12)(14,15)/rA:17nCCCCCCCNCCCCCCCCN/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;d11;s12;d13;d10s14;s8;t16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14N2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:9.14847
Area:426.251
Solvation:-1.5078
Coulombic:-11.6394
Bond Count [?]
All:18
Single:11
Double:6
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:222.285
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.88
LogP (Chemaxon):3.68

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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