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Chemical ID: 6131799
Chemical ID:
6131799
Name [?]:
3-(4-ethyl-1-piperidyl)propan-1-amine
SMILES [?]:
CCC1CCN(CC1)CCCN
InChi [?]:
InChI=1/C10H22N2/c1-2-10-4-8-12(9-5-10)7-3-6-11/h10H,2-9,11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,10,4,8,11,9,5,7,3,12,6/E:(4,5)(8,9)/rA:12nCCCCCNCCCCCN/rB:s1;s2;s3;s4;s5;s6;s3s7;s6;s9;s10;s11;/rC:;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H22N2 |
All Atoms: | 12 |
Heavy Atoms: | 12 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.97208 |
Area: | 364.977 |
Solvation: | -1.15235 |
Coulombic: | -17.9415 |
Bond Count [?]
All: | 12 |
Single: | 12 |
Double: | 0 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 170.295 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 2 |
XLogP: | 1.59 |
LogP (Chemaxon): | 0.87 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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