Chemical ID: 7105190

CCN(CC)c1ccc(cc1)CNCc2ccncc2
Chemical ID:
7105190
Name [?]:
N,N-diethyl-4-(4-pyridylmethylaminomethyl)aniline
SMILES [?]:
CCN(CC)c1ccc(cc1)CNCc2ccncc2
InChi [?]:
InChI=1/C17H23N3/c1-3-20(4-2)17-7-5-15(6-8-17)13-19-14-16-9-11-18-12-10-16/h5-12,19H,3-4,13-14H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,5,2,4,8,10,7,11,16,20,17,19,12,14,9,15,6,18,13,3/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)/rA:20nCCNCCCCCCCCCNCCCCNCC/rB:s1;s2;s3;s4;s3;s6;d7;s8;d9;d6s10;s9;s12;s13;s14;s15;d16;s17;d18;d15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H23N3
All Atoms:43
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:10.0755
Area:506.174
Solvation:-2.57891
Coulombic:-20.4758
Bond Count [?]
All:21
Single:15
Double:6
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:269.385
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:3.05
LogP (Chemaxon):2.99

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