Chemical ID: 5659710

c1ccc2c(c1)cccc2CC3=[NH+]CCN3
Chemical ID:
5659710
Name [?]:
2-(1-naphthylmethyl)-1,3,4,5-tetrahydroimidazole
SMILES [?]:
c1ccc2c(c1)cccc2CC3=[NH+]CCN3
InChi [?]:
InChI=1/C14H14N2/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14/h1-7H,8-10H2,(H,15,16)/p+1
InChi Info:
AuxInfo=1/1/N:1,2,8,6,7,9,3,14,15,11,5,10,4,12,13,16/E:(8,9)(15,16)/rA:16nCCCCCCCCCCCCN+CCN/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;s11;d12;s13;s14;s12s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H15N2+
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:-22.2926
Area:381.384
Solvation:-31.8271
Coulombic:-4.84211
Bond Count [?]
All:18
Single:12
Double:6
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:211.282
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:2.53
LogP (Chemaxon):2.63

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