Chemical ID: 7510900

c1cc(c(c(c1)Cl)CN2CCC(CC2)C(=O)NC3CCCCCC3)F
Chemical ID:
7510900
Name [?]:
1-[(2-chloro-6-fluoro-phenyl)methyl]-N-cycloheptyl-piperidine-4-carboxamide
SMILES [?]:
c1cc(c(c(c1)Cl)CN2CCC(CC2)C(=O)NC3CCCCCC3)F
InChi [?]:
InChI=1/C20H28ClFN2O/c21-18-8-5-9-19(22)17(18)14-24-12-10-15(11-13-24)20(25)23-16-6-3-1-2-4-7-16/h5,8-9,15-16H,1-4,6-7,10-14H2,(H,23,25)
InChi Info:
AuxInfo=1/1/N:21,22,20,23,1,19,24,6,2,11,13,10,14,8,12,18,4,5,3,15,7,25,17,9,16/E:(1,2)(3,4)(6,7)(10,11)(12,13)/rA:25nCCCCCCClCNCCCCCCONCCCCCCCF/rB:s1;d2;s3;d4;d1s5;s5;s4;s8;s9;s10;s11;s12;s9s13;s12;d15;s15;s17;s18;s19;s20;s21;s22;s18s23;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H28ClFN2O
All Atoms:53
Heavy Atoms:25
Chiral Atoms:None
ZAP Information [?]
Total:11.2294
Area:564.634
Solvation:-2.88649
Coulombic:-31.4272
Bond Count [?]
All:27
Single:23
Double:4
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.66
LogP (Chemaxon):None

Name Annotations

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Descriptor Annotations

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