Chemical ID: 4118483

Cc1cc(nc(n1)N(C)c2ccc(cc2)N)C
Chemical ID:
4118483
Name [?]:
N-(4,6-dimethylpyrimidin-2-yl)-N-methyl-benzene-1,4-diamine
SMILES [?]:
Cc1cc(nc(n1)N(C)c2ccc(cc2)N)C
InChi [?]:
InChI=1/C13H16N4/c1-9-8-10(2)16-13(15-9)17(3)12-6-4-11(14)5-7-12/h4-8H,14H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,17,9,12,14,11,15,3,2,4,13,10,6,16,7,5,8/E:(1,2)(4,5)(6,7)(9,10)(15,16)/rA:17nCCCCNCNNCCCCCCCNC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s8;s10;d11;s12;d13;d10s14;s13;s4;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H16N4
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.50118
Area:421.407
Solvation:-2.03399
Coulombic:-33.9644
Bond Count [?]
All:18
Single:12
Double:6
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:228.293
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:2.05
LogP (Chemaxon):1.65

Name Annotations

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Descriptor Annotations

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