Chemical ID: 7116487

CN(C)c1ccc(cc1)N2CCNCC2
Chemical ID:
7116487
Name [?]:
N,N-dimethyl-4-piperazin-1-yl-aniline
SMILES [?]:
CN(C)c1ccc(cc1)N2CCNCC2
InChi [?]:
InChI=1/C12H19N3/c1-14(2)11-3-5-12(6-4-11)15-9-7-13-8-10-15/h3-6,13H,7-10H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,3,5,9,6,8,12,14,11,15,4,7,13,2,10/E:(1,2)(3,4)(5,6)(7,8)(9,10)/rA:15nCNCCCCCCCNCCNCC/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;s11;s12;s13;s10s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H19N3
All Atoms:34
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.63563
Area:385.666
Solvation:-2.00602
Coulombic:-21.2157
Bond Count [?]
All:16
Single:13
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:205.299
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.84
LogP (Chemaxon):2.02

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Descriptor Annotations

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