Chemical ID: 6048117

C1C[NH2+]CCC1CC[NH3+]
Chemical ID:
6048117
Name [?]:
2-(3,4,5,6-tetrahydro-2H-pyridin-4-yl)ethylammonium
SMILES [?]:
C1C[NH2+]CCC1CC[NH3+]
InChi [?]:
InChI=1/C7H16N2/c8-4-1-7-2-5-9-6-3-7/h7,9H,1-6,8H2/p+2
InChi Info:
AuxInfo=1/1/N:7,1,5,8,2,4,6,9,3/E:(2,3)(5,6)/rA:9nCCN+CCCCCN+/rB:s1;s2;s3;s4;s1s5;s6;s7;s8;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H18N2+2
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:-92.1636
Area:292.739
Solvation:-99.482
Coulombic:103.875
Bond Count [?]
All:9
Single:9
Double:0
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:130.231
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:0.14
LogP (Chemaxon):-0.25

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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