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Chemical ID: 7177649
Chemical ID:
7177649
Name [?]:
N-(2-chlorophenyl)piperidin-4-amine
SMILES [?]:
c1ccc(c(c1)NC2CCNCC2)Cl
InChi [?]:
InChI=1/C11H15ClN2/c12-10-3-1-2-4-11(10)14-9-5-7-13-8-6-9/h1-4,9,13-14H,5-8H2
InChi Info:
AuxInfo=1/0/N:2,1,3,6,9,13,10,12,8,4,5,14,11,7/E:(5,6)(7,8)/rA:14nCCCCCCNCCCNCCCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;s10;s11;s8s12;s4;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H15ClN2 |
All Atoms: | 29 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.28836 |
Area: | 381.644 |
Solvation: | -1.25274 |
Coulombic: | -22.1596 |
Bond Count [?]
All: | 15 |
Single: | 12 |
Double: | 3 |
Rotors: | 2 |
Chiral: | 0 |
Rigid Segments: | 2 |
Chemical Properties
Molecular Weight: | 210.703 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 2 |
XLogP: | 2.45 |
LogP (Chemaxon): | 1.75 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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