Chemical ID: 7119204

Cc1ccc(cc1C)NCc2cc[nH+]cc2
Chemical ID:
7119204
Name [?]:
3,4-dimethyl-N-(1H-pyridin-4-ylmethyl)aniline
SMILES [?]:
Cc1ccc(cc1C)NCc2cc[nH+]cc2
InChi [?]:
InChI=1/C14H16N2/c1-11-3-4-14(9-12(11)2)16-10-13-5-7-15-8-6-13/h3-9,16H,10H2,1-2H3/p+1
InChi Info:
AuxInfo=1/1/N:1,8,3,4,12,16,13,15,6,10,2,7,11,5,14,9/E:(5,6)(7,8)/rA:16nCCCCCCCCNCCCCN+CC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;s10;s11;d12;s13;d14;d11s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H17N2+
All Atoms:33
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:-24.0314
Area:415.258
Solvation:-34.4129
Coulombic:-3.24902
Bond Count [?]
All:17
Single:11
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:213.298
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.0
LogP (Chemaxon):3.02

Name Annotations

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Descriptor Annotations

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