Chemical ID: 4177763

CN1CCC(CC1)NCc2cccc(c2)F
Chemical ID:
4177763
Name [?]:
N-[(3-fluorophenyl)methyl]-1-methyl-piperidin-4-amine
SMILES [?]:
CN1CCC(CC1)NCc2cccc(c2)F
InChi [?]:
InChI=1/C13H19FN2/c1-16-7-5-13(6-8-16)15-10-11-3-2-4-12(14)9-11/h2-4,9,13,15H,5-8,10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,11,13,4,6,3,7,15,9,10,14,5,16,8,2/E:(5,6)(7,8)/rA:16nCNCCCCCNCCCCCCCF/rB:s1;s2;s3;s4;s5;s2s6;s5;s8;s9;s10;d11;s12;d13;d10s14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H19FN2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.77002
Area:408.971
Solvation:-2.45426
Coulombic:-18.2227
Bond Count [?]
All:17
Single:14
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:222.302
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.09
LogP (Chemaxon):1.69

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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