Chemical ID: 4178939

CCN1CCC(CC1)N(CC)CCN(C)C
Chemical ID:
4178939
Name [?]:
N-ethyl-N-(1-ethyl-4-piperidyl)-N',N'-dimethyl-ethane-1,2-diamine
SMILES [?]:
CCN1CCC(CC1)N(CC)CCN(C)C
InChi [?]:
InChI=1/C13H29N3/c1-5-15-9-7-13(8-10-15)16(6-2)12-11-14(3)4/h13H,5-12H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,11,15,16,2,10,5,7,4,8,13,12,6,14,3,9/E:(3,4)(7,8)(9,10)/rA:16cCCNCCCCCNCCCCNCC/rB:s1;s2;s3;s4;s5;s6;s3s7;s6;s9;s10;s9;s12;s13;s14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H29N3
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:9.0411
Area:435.786
Solvation:-1.85354
Coulombic:-14.8581
Bond Count [?]
All:16
Single:16
Double:0
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:227.39
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.16
LogP (Chemaxon):0.8

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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