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Chemical ID: 5196575
Chemical ID:
5196575
Name [?]:
N-ethyl-N-[2-(2-methylimidazol-1-yl)ethyl]ethanamine
SMILES [?]:
CCN(CC)CCn1ccnc1C
InChi [?]:
InChI=1/C10H19N3/c1-4-12(5-2)8-9-13-7-6-11-10(13)3/h6-7H,4-5,8-9H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,5,13,2,4,10,9,6,7,12,11,3,8/E:(1,2)(4,5)/rA:13nCCNCCCCNCCNCC/rB:s1;s2;s3;s4;s3;s6;s7;s8;d9;s10;s8d11;s12;/rC:;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H19N3 |
All Atoms: | 13 |
Heavy Atoms: | 13 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.69023 |
Area: | 378.544 |
Solvation: | -1.77337 |
Coulombic: | -14.9654 |
Bond Count [?]
All: | 13 |
Single: | 11 |
Double: | 2 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 181.278 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 1.2 |
LogP (Chemaxon): | 0.95 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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