Chemical ID: 4232236

c1ccc(c(c1)NC(=O)CCN2CCCC2)F
Chemical ID:
4232236
Name [?]:
N-(2-fluorophenyl)-3-pyrrolidin-1-yl-propanamide
SMILES [?]:
c1ccc(c(c1)NC(=O)CCN2CCCC2)F
InChi [?]:
InChI=1/C13H17FN2O/c14-11-5-1-2-6-12(11)15-13(17)7-10-16-8-3-4-9-16/h1-2,5-6H,3-4,7-10H2,(H,15,17)
InChi Info:
AuxInfo=1/1/N:2,1,14,15,3,6,10,13,16,11,4,5,8,17,7,12,9/E:(3,4)(8,9)/rA:17nCCCCCCNCOCCNCCCCF/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;s10;s11;s12;s13;s14;s12s15;s4;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H17FN2O
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.97151
Area:419.956
Solvation:-2.5274
Coulombic:-29.711
Bond Count [?]
All:18
Single:14
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:236.285
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.63
LogP (Chemaxon):1.14

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Descriptor Annotations

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