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Chemical ID: 4288890
Chemical ID:
4288890
Name [?]:
4-(2-methyl-1-piperidyl)-1-propyl-piperidine
SMILES [?]:
CCCN1CCC(CC1)N2CCCCC2C
InChi [?]:
InChI=1/C14H28N2/c1-3-9-15-11-7-14(8-12-15)16-10-5-4-6-13(16)2/h13-14H,3-12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,16,2,13,12,14,6,8,3,11,5,9,15,7,4,10/E:(7,8)(11,12)/rA:16cCCCNCCCCCNCCCCCC/rB:s1;s2;s3;s4;s5;s6;s7;s4s8;s7;s10;s11;s12;s13;s10s14;s15;/rC:;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H28N2 |
All Atoms: | 16 |
Heavy Atoms: | 16 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 9.0886 |
Area: | 411.27 |
Solvation: | -1.19314 |
Coulombic: | -10.6629 |
Bond Count [?]
All: | 17 |
Single: | 17 |
Double: | 0 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 224.386 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 2 |
XLogP: | 2.56 |
LogP (Chemaxon): | 2.08 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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