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Chemical ID: 7509295
Chemical ID:
7509295
Name [?]:
N-(3-fluorophenyl)-1-propyl-piperidin-4-amine
SMILES [?]:
CCCN1CCC(CC1)Nc2cccc(c2)F
InChi [?]:
InChI=1/C14H21FN2/c1-2-8-17-9-6-13(7-10-17)16-14-5-3-4-12(15)11-14/h3-5,11,13,16H,2,6-10H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,13,14,12,6,8,3,5,9,16,15,7,11,17,10,4/E:(6,7)(9,10)/rA:17nCCCNCCCCCNCCCCCCF/rB:s1;s2;s3;s4;s5;s6;s7;s4s8;s7;s10;s11;d12;s13;d14;d11s15;s15;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H21FN2 |
All Atoms: | 38 |
Heavy Atoms: | 17 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 8.61987 |
Area: | 429.958 |
Solvation: | -2.12908 |
Coulombic: | -21.3507 |
Bond Count [?]
All: | 18 |
Single: | 15 |
Double: | 3 |
Rotors: | 4 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.01 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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Chemical Mix | Source | External ID | Descriptor | Value |
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