Chemical ID: 7116538

Cc1ccc(cc1N)N2CCNCC2
Chemical ID:
7116538
Name [?]:
2-methyl-5-piperazin-1-yl-aniline
SMILES [?]:
Cc1ccc(cc1N)N2CCNCC2
InChi [?]:
InChI=1/C11H17N3/c1-9-2-3-10(8-11(9)12)14-6-4-13-5-7-14/h2-3,8,13H,4-7,12H2,1H3
InChi Info:
AuxInfo=1/0/N:1,3,4,11,13,10,14,6,2,5,7,8,12,9/E:(4,5)(6,7)/rA:14nCCCCCCCNNCCNCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;s10;s11;s12;s9s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H17N3
All Atoms:31
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.31198
Area:361.057
Solvation:-1.71445
Coulombic:-31.3768
Bond Count [?]
All:15
Single:12
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:191.273
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:1.04
LogP (Chemaxon):1.43

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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