Chemical ID: 6658490

CCN(CC)c1ccc(c(c1)C)[NH+]=N
Chemical ID:
6658490
Name [?]:
(4-diethylamino-2-methyl-phenyl)-imino-ammonium
SMILES [?]:
CCN(CC)c1ccc(c(c1)C)[NH+]=N
InChi [?]:
InChI=1/C11H17N3/c1-4-14(5-2)10-6-7-11(13-12)9(3)8-10/h6-8,12H,4-5H2,1-3H3/p+1
InChi Info:
AuxInfo=1/1/N:1,5,12,2,4,7,8,11,10,6,9,14,13,3/E:(1,2)(4,5)/rA:14nCCNCCCCCCCCCN+N/rB:s1;s2;s3;s4;s3;s6;d7;s8;d9;d6s10;s10;s9;w13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H18N3+
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:-24.9559
Area:383.472
Solvation:-34.5427
Coulombic:5.39393
Bond Count [?]
All:14
Single:10
Double:4
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:192.281
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:3.52
LogP (Chemaxon):3.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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